Geometry & MOs

Info

ID:

342002

PubChem CID:

127264695

Reduced:

P2C45H52 (1)

Stoich.:

A2B45C52 (1)

Weight, g/mol:

918.358031

ΔHf, kcal/mol:

11.76

Dipole, Da:

2.56

IP(EA), eV:

 -8.19(0.43)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[2-[1-[2-bis(3,5-dimethylphenyl)phosphanylcyclopentyl]ethyl]phenyl]-[3,5-bis(trifluoromethyl)phenyl]-(2,5-dimethylphenyl)phosphane;carbanide;cyclopentane;iron(2+)

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)P(C2=CC=CC=C2C(C)C3CCCC3P(C4=CC(=CC(=C4)C)C)C5=CC(=CC(=C5)C)C)C6=CC(=CC(=C6)C)C

DOS

IR

Vibrations