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Tris[1-phenylisoquinoline-C2,N]iridium(III)

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Name

Tris[1-phenylisoquinoline-C2,N]iridium(III)

EINECS N/A
CAS No. 435293-93-9 Density N/A
PSA 38.67000 LogP 11.10600
Solubility N/A Melting Point 454 °C
Formula C45H30IrN3 Boiling Point N/A
Molecular Weight 804.96 Flash Point N/A
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 435293-93-9 (Ir(piq)3,  Tris[1-phenylisoquinolinato-C2,N]iridium(III)) Hazard Symbols N/A
Synonyms

Tris(1-phenylisoquinoline)iridium;

 

Tris[1-phenylisoquinoline-C2,N]iridium(III) Specification

This chemical is called Tris[1-phenylisoquinoline-C2,N]iridium(III), and its systematic name is tris[2-(isoquinolin-1-yl-kappaN)phenyl-kappaC1]iridium. With the molecular formula of C45H30IrN3, its molecular weight is 804.96. In addition, the CAS registry number of this chemical is 435293-93-9.

Other characteristics of the Tris[1-phenylisoquinoline-C2,N]iridium(III) can be summarised as followings: (1)#H bond acceptors: 3; (2)#H bond donors: 0; (3)Melting Point:  454 °C; (4)#Freely Rotating Bonds: 0; (5)Polar Surface Area: 11.64 Å2.

You can still convert the following datas into molecular structure: 
(1)SMILES: c1cccc%12c1[Ir-3]95(c2ccccc2c4[n+]5ccc3ccccc34)([n+]7ccc6ccccc6c7c8ccccc89)[n+]%11ccc%10ccccc%10c%11%12
(2)InChI: InChI=1/3C15H10N.Ir/c3*1-2-7-13(8-3-1)15-14-9-5-4-6-12(14)10-11-16-15;/h3*1-7,9-11H;/rC45H30IrN3/c1-4-16-34-31(13-1)25-28-47-43(34)37-19-7-10-22-40(37)46(47,41-23-11-8-20-38(41)44-35-17-5-2-14-32(35)26-29-48(44)46)42-24-12-9-21-39(42)45-36-18-6-3-15-33(36)27-30-49(45)46/h1-30H  

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