Geometry & MOs

Info

ID:	388345
PubChem CID:	134988847
Reduced:	SN2O4C11H22 (1)
Stoich.:	AB2C4D11E22 (1)
Weight, g/mol:	254.074167
ΔH_f, kcal/mol:	-62.08
Dipole, Da:	9.42
IP(EA), eV:	-10.24(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-diethoxyphosphoryl-1-(dimethyl-lambda4-sulfanylidene)propan-2-one

Drug info:

PubChemData

Smile

CCCCCS(=C([N+](=O)[O-])[N+](=O)[O-])CCCCC

DOS

IR

Vibrations