Geometry & MOs

Info

ID:	268272
PubChem CID:	103598672
Reduced:	SN2O4C20H24 (1)
Stoich.:	AB2C4D20E24 (1)
Weight, g/mol:	318.169191
ΔH_f, kcal/mol:	-117.07
Dipole, Da:	6.09
IP(EA), eV:	-8.74(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[3-[2-(butylcarbamoyl)hydrazinyl]-3-oxoprop-1-enyl]phenyl]acetamide

Drug info:

PubChemData

Smile

CCCS(=O)(=O)NC1=CC=CC(=C1C)NC(=O)C=CC2=CC(=CC=C2)OC

DOS

IR

Vibrations