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6569-51-3 Usage

Description

Borazole (borazine) is a colourless liquid with an aromatic smell. With water, it decomposes to form boric acid, ammonia, and hydrogen. The reaction product of boron and ammonia at high temperatures is also known as inorganic benzene.

Chemical Properties

inorganic analog of benzene; colorless liquid; preparation: heating equimolar mixture of ammonia and BH3 at 250°C–300°C for 30min [MER06] [HAW93]

Check Digit Verification of cas no

The CAS Registry Mumber 6569-51-3 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 6,5,6 and 9 respectively; the second part has 2 digits, 5 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 6569-51:
(6*6)+(5*5)+(4*6)+(3*9)+(2*5)+(1*1)=123
123 % 10 = 3
So 6569-51-3 is a valid CAS Registry Number.
InChI:InChI=1/B3H6N3/c1-4-2-6-3-5-1/h1-6H

6569-51-3SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 13, 2017

Revision Date: Aug 13, 2017

1.Identification

1.1 GHS Product identifier

Product name borazine

1.2 Other means of identification

Product number -
Other names Borazine

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:6569-51-3 SDS

6569-51-3Synthetic route

sodium tetrahydroborate
16940-66-2

sodium tetrahydroborate

B,B',B''-trichloroborazine
933-18-6

B,B',B''-trichloroborazine

borazine
6569-51-3

borazine

Conditions
ConditionsYield
92.6%
92.6%
In diethylene glycol46%
sodium tetrahydroborate
16940-66-2

sodium tetrahydroborate

ammonium sulfate

ammonium sulfate

borazine
6569-51-3

borazine

Conditions
ConditionsYield
aluminium trichloride In further solvent(s) (N2), powder of (NH4)2SO4 treated with soln. of NaBH4 in tetraglyme, stirred for 6 h at 140°C catalized by AlCl3;67%
In further solvent(s) byproducts: Na2SO4, H2; absence of air and moisture; heating in tetraglyme to 135°C (over 1 h), then 1 h at 135°C, continuous distn. off of borazine and H2 at 2-5 Torr; condensation in trap at liquid-N2 temp., fractional low-temp. distn. (collection at -78°C);59.9%
In further solvent(s) byproducts: Na2SO4, H2; absence of air and moisture; stepwise addn. of solid mixt. of educt into tetraglyme at 135°C, heating to 135°C for 2 h; condensation in trap at liquid-N2 temp., fractional low-temp. distn. (collection at -78°C);53.8%
ammonia borane complex
10043-11-5

ammonia borane complex

borazine
6569-51-3

borazine

Conditions
ConditionsYield
In further solvent(s) byproducts: H2; absence of air and moisture; slow addn. of solid H3NBH3 into tetraglymeat 140-160°C (over 3 h), distn. off of H2 and product (2-5 Torr); condensation in trap at liquid-N2 temp., fractional low-temp. distn. (collection at -78°C);67%
With nickel at 80℃; under 30 Torr; for 6h; Inert atmosphere;53%
In 1,2-dimethoxyethane
lithium borohydride

lithium borohydride

B,B',B''-trichloroborazine
933-18-6

B,B',B''-trichloroborazine

borazine
6569-51-3

borazine

Conditions
ConditionsYield
65%
65%
In dibutyl ether under N2; exclusion of moisture (drybox); B-trichloroborazine was suspended in the dry solvent; soln. of LiBH4 was added to the slurry over 2 h; crude borazine was distilled into a dry-ice condenser; several line transfers; fractional distillation; identified by IR; (1)H-NMR; boiling point;;
ammonia borane

ammonia borane

borazine
6569-51-3

borazine

Conditions
ConditionsYield
[Re(NO)(η(2)-H2)Br2(PiPr3)2] In 1,4-dioxane byproducts: H2; at 45°C for 24 h, or at 85°C for 1 h;65%
chloro(1,5-cyclooctadiene)rhodium(I) dimer In further solvent(s) byproducts: H2; at 45°C for 72 h in tetraglime; NMR;10%
chloro(1,5-cyclooctadiene)rhodium(I) dimer In diethylene glycol dimethyl ether byproducts: H2; at 45°C for 72 h; NMR;10%
diborane
19287-45-7

diborane

borazine
6569-51-3

borazine

Conditions
ConditionsYield
With ammonia byproducts: H2; quickly heating at 250-300°C;47%
With NH3 byproducts: H2; quickly heating at 250-300°C;47%
With ammonia byproducts: H2; heating at 200°C and 11 atm; 15 min;41.5%
B2H5NH2*NH3

B2H5NH2*NH3

borazine
6569-51-3

borazine

Conditions
ConditionsYield
heating at 200°C 5 min;45%
heating at 200°C 5 min;45%
byproducts: H2; at 200°C 5 min;>99
lithium borohydride

lithium borohydride

ammonium chloride

ammonium chloride

borazine
6569-51-3

borazine

Conditions
ConditionsYield
40%
40%
cyclotriborane
13871-09-5

cyclotriborane

A

BNH1.7

BNH1.7

B

borazine
6569-51-3

borazine

Conditions
ConditionsYield
In solid byproducts: H2; heated in Schlenk vessel up to 470 K; held at this temp. for 6 h before slowly cooled down; monitored by NMR spectroscopy;A n/a
B 40%
B4H10*4NH3

B4H10*4NH3

borazine
6569-51-3

borazine

Conditions
ConditionsYield
With ammonia heating at 200°C;40%
With NH3 heating at 200°C;40%
at 200°C in sealed tube;
at 200°C in sealed tube;
B2H6*NH3*PH3

B2H6*NH3*PH3

borazine
6569-51-3

borazine

Conditions
ConditionsYield
quickly heating to 200°C;30%
quickly heating to 200°C;30%
NH4(1+)*BH3*PH2(1-)*BH3=B2H6*PH3*NH3

NH4(1+)*BH3*PH2(1-)*BH3=B2H6*PH3*NH3

borazine
6569-51-3

borazine

Conditions
ConditionsYield
fast heating up to 200°C;30%
fast heating up to 200°C;30%
ammonia borane

ammonia borane

A

cyclotriborane
13871-09-5

cyclotriborane

B

borazine
6569-51-3

borazine

Conditions
ConditionsYield
In diethylene glycol 30 min, 130°C; identified by 11B NMR spectroscopy;;A 27%
B n/a
sodium tetrahydroborate
16940-66-2

sodium tetrahydroborate

ammonium chloride

ammonium chloride

borazine
6569-51-3

borazine

Conditions
ConditionsYield
23%
23%
sodium tetrahydroborate
16940-66-2

sodium tetrahydroborate

ammonium sulfate

ammonium sulfate

A

ammonia borane complex
10043-11-5

ammonia borane complex

B

μ-aminodiborane
75885-49-3

μ-aminodiborane

C

cyclotriborane
13871-09-5

cyclotriborane

D

borazine
6569-51-3

borazine

Conditions
ConditionsYield
In further solvent(s) byproducts: H2; under Ar atm.; grinded (NH4)2SO4 and NaBH4 stirred in triglyme heated to120°C for 30 min, treated at this temp. until the cease of gases released; mixt. distd. several times under high vac., collected in liq. N2 traps, condensed at -78°C; detd. by XRD, NMR, mass-spectrometry;A n/a
B n/a
C n/a
D 18%
lithium borohydride

lithium borohydride

B,B',B''-trichloroborazine
933-18-6

B,B',B''-trichloroborazine

A

B-monochloroborazine
15061-65-1

B-monochloroborazine

B

borazine
6569-51-3

borazine

Conditions
ConditionsYield
Stage #1: B,B',B''-trichloroborazine With pyridine In diethyl ether at -78℃; for 0.0833333h; Inert atmosphere; Schlenk technique; Glovebox;
Stage #2: lithium borohydride at 20℃; for 0.5h; Inert atmosphere; Schlenk technique; Glovebox;
A 17%
B n/a
ammonium tetrafluoroborate

ammonium tetrafluoroborate

A

poly(boron amide imide)

poly(boron amide imide)

B

borazine
6569-51-3

borazine

Conditions
ConditionsYield
byproducts: H2; decompn. at different temp. values;A n/a
B 15%
byproducts: H2; decompn. at different temp. values;A n/a
B 15%
sodium tetrahydroborate
16940-66-2

sodium tetrahydroborate

hydrazine hydrochloride
2644-70-4

hydrazine hydrochloride

borazine
6569-51-3

borazine

Conditions
ConditionsYield
cobalt at 175 - 180°C, heating;
cobalt at 175 - 180°C, heating;
B5H9*4NH3

B5H9*4NH3

borazine
6569-51-3

borazine

Conditions
ConditionsYield
200°C;
tetra-amminezinc tetrahydroborate

tetra-amminezinc tetrahydroborate

A

ammonia borane
108203-18-5

ammonia borane

B

borazine
6569-51-3

borazine

C

diborane
19287-45-7

diborane

Conditions
ConditionsYield
In neat (no solvent) Kinetics; thermal decompn. (vac., 1 Pa, glass ampoule in stainless steel capsule, 120°C, 95 min); further products; mass spectrometry;
tetra-amminezinc tetrahydroborate

tetra-amminezinc tetrahydroborate

A

ammonia borane
108203-18-5

ammonia borane

B

borazine
6569-51-3

borazine

Conditions
ConditionsYield
In neat (no solvent) Kinetics; thermal decompn. (vac., 1 Pa, glass ampoule in stainless steel capsule, 47°C, 25 min or 60°C, 50 min); further products; mass spectrometry;
dimethylamine borane
1838-13-7

dimethylamine borane

n-propylamine borane complex

n-propylamine borane complex

A

borazine
6569-51-3

borazine

B

methylamine borane

methylamine borane

Conditions
ConditionsYield
byproducts: H2; 60-70°C, then 3 h, 85-90°C;
byproducts: H2; 60-70°C, then 3 h, 85-90°C;
dimethylamine borane
1838-13-7

dimethylamine borane

isopropylamine borane complex
879631-61-5

isopropylamine borane complex

A

borazine
6569-51-3

borazine

B

methylamine borane

methylamine borane

Conditions
ConditionsYield
byproducts: H2; 60-70°C, then 3 h, 85-90°C;
byproducts: H2; 60-70°C, then 3 h, 85-90°C;
dimethylamine borane
1838-13-7

dimethylamine borane

methylamine borane

methylamine borane

borazine
6569-51-3

borazine

Conditions
ConditionsYield
byproducts: H2; 60-70°C, then 3 h at 85-90°C;
byproducts: H2; 60-70°C, then 3 h at 85-90°C;
diborane
19287-45-7

diborane

A

boron imide

boron imide

B

borazine
6569-51-3

borazine

Conditions
ConditionsYield
With NH3 NH3:B2H6 mol ratio = 9:1;A n/a
B 0%
With NH3 heating with NH3 excess;
diborane
19287-45-7

diborane

A

aminodiborane
39046-41-8

aminodiborane

B

borazine
6569-51-3

borazine

Conditions
ConditionsYield
With NH3 with B2H6 excess;
With NH3 with B2H6 excess;
ammonia
7664-41-7

ammonia

diborane
19287-45-7

diborane

borazine
6569-51-3

borazine

lithium aluminium tetrahydride
16853-85-3

lithium aluminium tetrahydride

B,B',B''-trichloroborazine
933-18-6

B,B',B''-trichloroborazine

borazine
6569-51-3

borazine

Conditions
ConditionsYield
In diethylene glycol
In diethylene glycol dimethyl ether
B.B-Dimethyl-borazen
15973-91-8

B.B-Dimethyl-borazen

A

borazine
6569-51-3

borazine

B

ammonia
7664-41-7

ammonia

Conditions
ConditionsYield
With water
With H2O
ethene
74-85-1

ethene

borazine
6569-51-3

borazine

2-ethylcyclotriborazine
88916-94-3

2-ethylcyclotriborazine

Conditions
ConditionsYield
hydridocarbonyltris(triphenylphosphine)rhodium(I) In neat (no solvent) Kinetics; borazine and ethylene (7.9:1 ratio) were condensed (-196°C) to acatalytic amt. Rh-complex, mixt. allowed to warm to room temp., initialyellow soln. turned reddish brown within min and became homogeneous, mixt. stirred 1 h; flask frozen on vacuum line (-196°C) and degassed, volatile material fractionated through a -78, -110 and -196°C trap series, product found in the -78°C trap;100%
propene
187737-37-7

propene

borazine
6569-51-3

borazine

B-propylborazine
121232-06-2

B-propylborazine

Conditions
ConditionsYield
hydridocarbonyltris(triphenylphosphine)rhodium(I) In neat (no solvent) Kinetics; borazine and propylene (8.5 to 7.5 :1) reacted in the presence of a catalytic amt. Rh-complex at room temp. for 2 h; vacuum line fractionation of mixt. through a -63, -110 and -196°C trap series, product found in the -63°C trap;98%
1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

borazine
6569-51-3

borazine

2-(trifluoropropyl)borazine
155862-04-7

2-(trifluoropropyl)borazine

Conditions
ConditionsYield
hydridocarbonyltris(triphenylphosphine)rhodium(I) In neat (no solvent) Kinetics; borazine and the propene (ratio 8.4:1) reacted in the presence of a catalytic amt. Rh-complex at room temp. for 1 h; vacuum line fractionation of mixt. through a 0, -45, -110 and -196°C trap series, product found in the -45°C trap, elem. anal.;98%
1,3,5-trimethyl-1,3,5-trivinyl-1,3,5-trisila-2,4,6-triazacyclohexane
5505-72-6

1,3,5-trimethyl-1,3,5-trivinyl-1,3,5-trisila-2,4,6-triazacyclohexane

borazine
6569-51-3

borazine

polimer from 2,4,6-trimethyl-2,4,6-trivinylcyclotrisilazane and borazine

polimer from 2,4,6-trimethyl-2,4,6-trivinylcyclotrisilazane and borazine

Conditions
ConditionsYield
In tetrahydrofuran at 0 - 2℃; for 35h;95%
ethene
74-85-1

ethene

borazine
6569-51-3

borazine

2,4,6-triethyl-borazine
7443-22-3

2,4,6-triethyl-borazine

Conditions
ConditionsYield
hydridocarbonyltris(triphenylphosphine)rhodium(I) In neat (no solvent) Kinetics; borazine and excess ethylene (1:3 ratio) were condensed (-196°C)to a catalytic amt. Rh-complex, mixt. allowed to warm to room temp., mixt. stirred 2 h; flask frozen on vacuum line (-196°C) and degassed, volatile material fractionated through traps at -63 and -196°C, product found in the -63°C trap;92%
1-butylene
106-98-9

1-butylene

borazine
6569-51-3

borazine

2-butylborazine
155862-03-6

2-butylborazine

Conditions
ConditionsYield
hydridocarbonyltris(triphenylphosphine)rhodium(I) In neat (no solvent) Kinetics; borazine and 1-butene (ratio 5.8:1) reacted in the presence of a catalytic amt. Rh-complex at room temp. for 3 h; vacuum line fractionation of mixt. through a -45, -110 and -196°C trap series, product found in the -45°C trap, elem. anal.;91%
1,1,1-trifluoropropylene
677-21-4

1,1,1-trifluoropropylene

borazine
6569-51-3

borazine

A

2-(trifluoropropyl)borazine
155862-04-7

2-(trifluoropropyl)borazine

B

2,4-bis-(trifluoropropyl)borazine
155862-05-8

2,4-bis-(trifluoropropyl)borazine

C

2,4,6-tris-(trifluoropropyl)borazine
155862-06-9

2,4,6-tris-(trifluoropropyl)borazine

Conditions
ConditionsYield
hydridocarbonyltris(triphenylphosphine)rhodium(I) In neat (no solvent) Kinetics; borazine and excess of the propene (ratio 1:2.9) reacted in the presence of a catalytic amt. Rh-complex at room temp. for 16 h, resulting product was a solid with a moist appearance; vacuum line fractionation of mixt. through a -78 and -196°C traps, 2-substd. and 2,4-products found in the -78°C trap; extn. (CH2Cl2) of solid residue, evapn. (ac.), solid sublimed at 80°C (2,4,6-product), elem. anal.;A 14%
B 84%
C n/a
borazine
6569-51-3

borazine

isopropenylbenzene
98-83-9

isopropenylbenzene

2-phenyl-3-(2-borazinyl)propane
155862-08-1

2-phenyl-3-(2-borazinyl)propane

Conditions
ConditionsYield
hydridocarbonyltris(triphenylphosphine)rhodium(I) In neat (no solvent) Kinetics; borazine and the styrene (ratio 4:1) reacted in the presence of a catalytic amt. Rh-complex at room temp. for 76 h; vacuum line fractionation of mixt. through a 0, -45 and -196°C trap series, product found in the 0°C trap;74%
trans-2-Butene
624-64-6

trans-2-Butene

borazine
6569-51-3

borazine

2-butylborazine
155862-03-6

2-butylborazine

Conditions
ConditionsYield
hydridocarbonyltris(triphenylphosphine)rhodium(I) In neat (no solvent) Kinetics; borazine and trans-2-butene (ratio 6:1) reacted in the presence of a catalytic amt. Rh-complex at room temp. for 185 h; vacuum line fractionation of mixt. through a -45, -110 and -196°C trap series, product found in the -45°C trap;72%
borazine
6569-51-3

borazine

acetylene
74-86-2

acetylene

poly(B-vinylborazine)
110272-04-3

poly(B-vinylborazine)

Conditions
ConditionsYield
carbonylhydridetris(triphenylphosphine)rhodium(I) room temp.; 4 h;;71.8%
hydridocarbonyltris(triphenylphosphine)rhodium(I) In neat (no solvent) RhH(CO9(PPh3)3 in a Fischer-Porter glass pressure vessel, evacuating, condensing B3N3H6 and C2H2 into the flask at -196°C, allowing to warm to room temp., 4 h; attaching to vac. line, freezing at -196°C, degassing, fractionating through a -30,-70,-116,-196 °C trap series;71.8%
With catalyst: Ir(I)-compound In not given 55°C;
ethene
74-85-1

ethene

borazine
6569-51-3

borazine

A

2-ethylcyclotriborazine
88916-94-3

2-ethylcyclotriborazine

B

B3H(C2H5)2(NH)3
89123-50-2

B3H(C2H5)2(NH)3

C

2,4,6-triethyl-borazine
7443-22-3

2,4,6-triethyl-borazine

Conditions
ConditionsYield
hydridocarbonyltris(triphenylphosphine)rhodium(I) In neat (no solvent) Kinetics; borazine and excess ethylene (1:3.5 ratio) were condensed (-196°C) to a catalytic amt. Rh-complex, mixt. allowed to warm to room temp., mixt. turned reddish brown within min, mixt. stirred 26 h; flask frozen on vacuum line (-196°C) and degassed, volatile material fractionated through traps at -78, -110 and -196°C, productsfound in the -78°C trap, identified by GC/MS;A 65%
B 29.5%
C 5.5%
propene
187737-37-7

propene

borazine
6569-51-3

borazine

A

B3H(C3H7)2(NH)3
155862-02-5

B3H(C3H7)2(NH)3

B

(B-n-C3H7NH)3
90723-42-5

(B-n-C3H7NH)3

Conditions
ConditionsYield
hydridocarbonyltris(triphenylphosphine)rhodium(I) In neat (no solvent) Kinetics; borazine and excess propylene (1:3.3) reacted in the presence of a catalytic amt. Rh-complex at room temp. for 1 h; vacuum line fractionation of mixt. through a -63, -110 and -196°C trap series, products found in the -63°C trap, products sepd. by vacuum line fractionation with condensation in -30 and 0°C traps (2,4- respectively 2,4,6-product);A 39.5%
B 60.5%
borazine
6569-51-3

borazine

boron nitride
10043-11-5

boron nitride

Conditions
ConditionsYield
In neat (no solvent) pyrolysis under pressure (100 MPa) at temperatures between 250°C and 700°C (N2), elem.anal.;60%
In neat (no solvent) High Pressure; borazine sealed under N2 in a gold capsule, pyrolyzed at 250-700°C, 25-100MPa, heating rate 10°C/min;
In neat (no solvent) preparation of BN layers by induction heating of borazol;
In neat (no solvent, gas phase) byproducts: H2; deposition on varius substrates;
N2-carrying gas, chemical vapor deposition (graphite substrate, 1300-1800°C, 100-10000 Pa); detd. by IR spectroscopy;
Estragole
140-67-0

Estragole

borazine
6569-51-3

borazine

1-(4-methoxyphenyl)-3-(2-borazinyl)propane
155862-09-2

1-(4-methoxyphenyl)-3-(2-borazinyl)propane

Conditions
ConditionsYield
hydridocarbonyltris(triphenylphosphine)rhodium(I) In neat (no solvent) Kinetics; borazine and the anisole (ratio 10.5:1) reacted in the presence of a catalytic amt. Rh-complex at room temp. for 96.5 h; vacuum line fractionation of mixt. through a 0, -45 and -196°C trap series, product found in the 0°C trap;57%
borazine
6569-51-3

borazine

4-nitro-aniline
100-01-6

4-nitro-aniline

H2NB(NHC6H4-4-NO2)2
3905-97-3

H2NB(NHC6H4-4-NO2)2

Conditions
ConditionsYield
In diethylene glycol 3 h;39%
In diethyl ether 3 h;39%
In diethyl ether 3 h;39%
In diethylene glycol dimethyl ether 3 h;39%
propene
187737-37-7

propene

borazine
6569-51-3

borazine

A

B-2-propenylborazine
110272-06-5

B-2-propenylborazine

B

B-trans(1-propenyl)borazine
110272-05-4

B-trans(1-propenyl)borazine

C

B-propylborazine
121232-06-2

B-propylborazine

Conditions
ConditionsYield
palladium(II) bromide In neat (no solvent) stirring in vac., in a Fischer-Porter pressure reactor, room temp., 6 h; vac. line fractionation through a -65 °C trap, mixture of B-propyl- and B-propenylborazine, separation of the propenyl compds. by preparative GLC;A n/a
B n/a
C 22%

6569-51-3Relevant articles and documents

Osmium-promoted dehydrogenation of amine-boranes and B-H bond activation of the resulting amino-boranes

Esteruelas, Miguel A.,Fernandez, Israel,Lopez, Ana M.,Mora, Malka,Onate, Enrique

, p. 1104 - 1107 (2014)

The five-coordinate osmium complex OsH(SH)(CO)(PiPr 3)2, containing an electrophilic center bonded to the soft hydrogen sulfide ligand, promotes dehydrogenation of amine-boranes and captures the amino-borane products, form

Dahl,Schaeffer

, (1960)

Schlesinger, H. I.,Ritter, D. M.,Burg, A. B.

, p. 1296 - 1300 (1938)

Efficient catalytic conversion of ammonia borane to borazine and its use for hexagonal boron nitride (white graphene)

Kim, Sung-Kwan,Cho, Hyunjin,Kim, Myung Jong,Lee, Hee-Jun,Park, Jin-Hyung,Lee, Young-Boo,Kim, Hwan Chul,Yoon, Chang Won,Nam, Suk Woo,Kang, Sang Ook

, p. 1976 - 1981 (2013)

Nickel nanoparticles (NiNPs) prepared in tetraglyme (TG) efficiently catalyzed the conversion of ammonia borane (AB, NH3BH3) to borazine (B3N3H6). Under the optimized conditions, 3 mol% of the NiNPs were introduced into a 1.5 M AB solution in TG and held at 80 °C for 6 h under a dynamic vacuum that was maintained at 30 torr. Borazine was isolated through a series of -45 °C, -78 °C, and -196 °C traps to give (-78 °C trap) pure borazine in 53% yield. The borazine produced was then utilized as a molecular precursor for high quality h-BN (white graphene) and large area h-BN sheets were prepared by applying low pressure chemical vapor deposition (LPCVD). Ultra-thin (single to few layers) h-BN was synthesized on Ni foil at the optimal ratio between borazine and NH3, and the number of layers was tuned by varying the NH3 partial pressure. The Royal Society of Chemistry 2013.

Thermolysis and solid state NMR studies of NaB3H8, NH3B3H7, and NH4B3H 8

Huang, Zhenguo,Eagles, Mitch,Porter, Spencer,Sorte, Eric G.,Billet, Beau,Corey, Robert L.,Conradi, Mark S.,Zhao, Ji-Cheng

, p. 701 - 708 (2013)

In an effort to broaden the search for high-capacity hydrogen storage materials, three triborane compounds, NaB3H8, NH 3B3H7, and NH4B3H 8, were studied. In addition to hydrogen, thermal decomposition also releases volatile boranes, and the relative amounts and species depend on the cations (Na+, NH4+) and the Lewis base (NH 3). Static-sample hydrogen NMR is used to probe molecular motion in the three solids. In each case, the line width decreases from low temperatures to room temperature in accordance with a model of isotropic or nearly isotropic reorientations. Such motions also explain a deep minimum in the relaxation time T1. Translational diffusion never appears to be rapid on the 10 -5 s time scale of NMR.

Dehydrogenation of ammonia-borane by Shvo's catalyst

Conley, Brian L.,Williams, Travis J.

, p. 4815 - 4817 (2010)

Shvo's cyclopentadienone-ligated ruthenium complex is an efficient catalyst for the liberation of exactly two molar equivalents of hydrogen from ammonia-borane, a prospective hydrogen storage medium. The mechanism for the dehydrogenation features a ruthenium hydride resting state from which dihydrogen loss is the rate-determining step.

Bismuthanylstibanes

Chitnis, Saurabh S.,Marczenko, Katherine M.

, p. 8015 - 8018 (2020)

Thermally-robust bismuthanylstibanes are prepared in a one-step, high yield reaction, providing the first examples of neutral Bi-Sb σ-bonds in the solid state. DFT calculations indicate that the bis(silylamino)naphthalene scaffold is well-suited for supporting otherwise labile bonds. The reaction chemistry of the Bi-Sb bond is debuted by showing fission using NH3BH3 and insertion of a sulfur atom, the latter providing the first example of a Bi-S-Sb motif. This journal is

Amine-Borane Dehydrogenation and Transfer Hydrogenation Catalyzed by α-Diimine Cobaltates

Maier, Thomas M.,Sandl, Sebastian,Shenderovich, Ilya G.,Jacobi von Wangelin, Axel,Weigand, Jan J.,Wolf, Robert

, p. 238 - 245 (2019/01/04)

Anionic α-diimine cobalt complexes, such as [K(thf)1.5{(DippBIAN)Co(η4-cod)}] (1; Dipp=2,6-diisopropylphenyl, cod=1,5-cyclooctadiene), catalyze the dehydrogenation of several amine-boranes. Based on the excellent catalytic properties, an especially effective transfer hydrogenation protocol for challenging olefins, imines, and N-heteroarenes was developed. NH3BH3 was used as a dihydrogen surrogate, which transferred up to two equivalents of H2 per NH3BH3. Detailed spectroscopic and mechanistic studies are presented, which document the rate determination by acidic protons in the amine-borane.

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