Geometry & MOs

Info

ID:	158481
PubChem CID:	56463928
Reduced:	NSO6C21H27 (1)
Stoich.:	ABC6D21E27 (1)
Weight, g/mol:	408.146741
ΔH_f, kcal/mol:	-205.5
Dipole, Da:	5.09
IP(EA), eV:	-8.87(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[3-(2-oxopyrrolidin-1-yl)propanoyl]-4-pyrrolidin-1-ylsulfonylbenzohydrazide

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)C(=O)NCCS(=O)(=O)CC)OCCOC2=CC=CC=C2

DOS

IR

Vibrations