Geometry & MOs

Info

ID:

226349

PubChem CID:

87350530

Reduced:

KO2C7H12 (1)

Stoich.:

AB2C7D12 (1)

Weight, g/mol:

402.362668

ΔHf, kcal/mol:

-112.89

Dipole, Da:

7.34

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.797888

Charge, e:

 0

Chem-info

IUPAC name:

didodecoxyphosphane

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)/C=C/O.[K]

DOS

IR

Vibrations