Geometry & MOs

Info

ID:	67693
PubChem CID:	46506980
Reduced:	O2N3C21H21 (1)
Stoich.:	A2B3C21D21 (1)
Weight, g/mol:	400.120526
ΔH_f, kcal/mol:	-27.47
Dipole, Da:	3.58
IP(EA), eV:	-9.08(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(4-ethoxyphenyl)sulfamoyl]-N-(4-methylphenyl)-1H-pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

C1CC2C(=NC3=CC=CC=C3N(C2=O)CC(=O)NCC4=CC=CC=C4)C1

DOS

IR

Vibrations