Geometry & MOs

Info

ID:	178511
PubChem CID:	76340065
Reduced:	O5N6H22C24 (1)
Stoich.:	A5B6C22D24 (1)
Weight, g/mol:	392.119464
ΔH_f, kcal/mol:	-83.21
Dipole, Da:	5.62
IP(EA), eV:	-8.4(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(benzenesulfonamido)phenyl]-3-(4-methylphenyl)prop-2-enamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)NC(=O)CN2C=C(C=N2)NC(=O)CNC(=O)C3C=NC4=CC=CC=C4C3=O

DOS

IR

Vibrations