Geometry & MOs

Info

ID:	11480
PubChem CID:	116069
Reduced:	NSP2O8C9H13 (1)
Stoich.:	ABC2D8E9F13 (1)
Weight, g/mol:	356.983712
ΔH_f, kcal/mol:	-369.4
Dipole, Da:	6.12
IP(EA), eV:	-10.04(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[dimethoxyphosphorylsulfanyl(methoxy)phosphoryl]oxy-4-nitrobenzene

Drug info:

PubChemData

Smile

COP(=O)(OC)SP(=O)(OC)OC1=CC=C(C=C1)[N+](=O)[O-]

DOS

IR

Vibrations