Geometry & MOs

Info

ID:	389599
PubChem CID:	134993963
Reduced:	N2O2C9H12 (1)
Stoich.:	A2B2C9D12 (1)
Weight, g/mol:	382.09225
ΔH_f, kcal/mol:	-45.65
Dipole, Da:	4.91
IP(EA), eV:	-9.46(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(dicyclohexyl-iodo-methyl-lambda5-phosphanyl)ethanone

Drug info:

PubChemData

Smile

CCOC(=O)/C=C\CN1C=CN=C1

DOS

IR

Vibrations