Geometry & MOs

Info

ID:	156951
PubChem CID:	56394955
Reduced:	ON2C14H17 (2)
Stoich.:	AB2C14D17 (2)
Weight, g/mol:	412.039689
ΔH_f, kcal/mol:	-16.91
Dipole, Da:	3.49
IP(EA), eV:	-8.57(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(5-chloro-2-cyanophenyl)sulfonylamino]-N-pyridin-4-ylbenzamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1CCC(=O)NC2=CC=CC=C2N3CCN(CC3)CCC4=CC=NC=C4

DOS

IR

Vibrations