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Cas Database |
| Name |
Iron, bis(cyano-kappaC)bis(1,10-phenanthroline-kappaN1,kappaN10)- |
EINECS | 238-833-9 |
| CAS No. | 14768-11-7 | Density | N/A |
| PSA | 99.14000 | LogP | 5.59706 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C26H16FeN6 | Boiling Point | 365.1 °C at 760 mmHg |
| Molecular Weight | 468.3 | Flash Point | 164.8 °C |
| Transport Information | 2811 | Appearance | N/A |
| Safety | 36/37/39-45 | Risk Codes | 25 |
| Molecular Structure |
|
Hazard Symbols | T |
| Synonyms |
Iron,bis(cyano-C)bis(1,10-phenanthroline-N1,N10)-;Iron,dicyanobis(1,10-phenanthroline)- (6CI,7CI,8CI);Bis(cyano)bis(1,10-phenanthroline)iron(2+);Bis(cyano)bis(9,10-phenanthroline)Fe(II);Dicyanobis(1,10-phenanthroline)iron;Dicyanobis(1,10-phenanthroline)iron(II); |
Article Data | 5 |
Iron, bis(cyano-kappaC)bis(1,10-phenanthroline-kappaN1,kappaN10)- Specification
This chemical is called Iron, bis(cyano-kappaC)bis(1,10-phenanthroline-kappaN1,kappaN10)-, and its CAS registry number is 14768-11-7. With the molecular formula of C26H16FeN6, its molecular weight is 468.29.
Other characteristics of the Iron, bis(cyano-kappaC)bis(1,10-phenanthroline-kappaN1,kappaN10)- can be summarised as followings: (1)ACD/LogP: 1.78; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 25.78 Å2; (7)Flash Point: 164.8 °C; (8)Enthalpy of Vaporization: 58.73 kJ/mol; (9)Boiling Point: 365.1 °C at 760 mmHg; (10)Vapour Pressure: 3.38E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: [Fe+2].[C-]#N.[C-]#N.n3c2c1ncccc1ccc2ccc3.n1c3c(ccc1)ccc2cccnc23
2.InChI: InChI=1/2C12H8N2.2CN.Fe/c2*1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;2*1-2;/h2*1-8H;;;/q;;2*-1;+2
3.InChIKey: YAQXGBBDJYBXKL-UHFFFAOYAL
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