Geometry & MOs

Info

ID:	183828
PubChem CID:	77074910
Reduced:	SO2C6H10 (1)
Stoich.:	AB2C6D10 (1)
Weight, g/mol:	267.096754
ΔH_f, kcal/mol:	-82.09
Dipole, Da:	5.84
IP(EA), eV:	-9.0(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1H-imidazol-5-ylmethyl)-5-nitro-2-oxopiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(=CCSC)C(=O)O

DOS

IR

Vibrations