Geometry & MOs

Info

ID:	406208
PubChem CID:	135076870
Reduced:	MoOH10C12 (1)
Stoich.:	ABC10D12 (1)
Weight, g/mol:	396.004479
ΔH_f, kcal/mol:	175.31
Dipole, Da:	5.53
IP(EA), eV:	-6.84(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,2-dichloro-1-diethoxyphosphorylethenyl)-3-nitrobenzamide

Drug info:

PubChemData

Smile

COC(=[Mo])C1=CC2=CC=CC=C2C=C1

DOS

IR

Vibrations