Geometry & MOs

Info

ID:	163735
PubChem CID:	58874722
Reduced:	NSF3O4H14C22 (1)
Stoich.:	ABC3D4E14F22 (1)
Weight, g/mol:	321.041942
ΔH_f, kcal/mol:	-188.7
Dipole, Da:	4.31
IP(EA), eV:	-9.4(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-nitro-N-(2-sulfamoylphenyl)benzamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)C(F)(F)F)C#CC2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)C(=O)O

DOS

IR

Vibrations