Geometry & MOs

Info

ID:	69685
PubChem CID:	47205172
Reduced:	SN2O4C10H18 (1)
Stoich.:	AB2C4D10E18 (1)
Weight, g/mol:	319.039355
ΔH_f, kcal/mol:	-191.35
Dipole, Da:	6.75
IP(EA), eV:	-9.87(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[2-[(1,1-dioxothiolan-3-yl)amino]-2-oxoethyl]-1H-pyrrole-2-carboxamide

Drug info:

PubChemData

Smile

CCC(=O)N(C)CC(=O)NC1CCS(=O)(=O)C1

DOS

IR

Vibrations