Geometry & MOs

Info

ID:	156889
PubChem CID:	56394836
Reduced:	BrClS2N3O4C14H15 (1)
Stoich.:	ABC2D3E4F14G15 (1)
Weight, g/mol:	447.125277
ΔH_f, kcal/mol:	-105.1
Dipole, Da:	7.43
IP(EA), eV:	-8.63(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-ethoxynaphthalen-1-yl)sulfonylamino]-N-pyridin-4-ylbenzamide

Drug info:

PubChemData

Smile

CNC1=C(C=C(C=C1)S(=O)(=O)NC)NS(=O)(=O)C2=C(C=C(C=C2)Br)Cl

DOS

IR

Vibrations