Geometry & MOs

Info

ID:	177782
PubChem CID:	76230214
Reduced:	NO2C11H15 (2)
Stoich.:	AB2C11D15 (2)
Weight, g/mol:	442.075406
ΔH_f, kcal/mol:	-97.21
Dipole, Da:	3.77
IP(EA), eV:	-8.57(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chloro-4-methoxyphenyl)-4-(2-phenylethenylsulfonylamino)benzamide

Drug info:

PubChemData

Smile

CCCCN(CC)C(=O)C=CC1=CC(=C(C=C1)OCC2=C(ON=C2C)C)OC

DOS

IR

Vibrations