Geometry & MOs

Info

ID:	243895
PubChem CID:	99300577
Reduced:	OSCl2N2H14C18 (1)
Stoich.:	ABC2D2E14F18 (1)
Weight, g/mol:	496.097204
ΔH_f, kcal/mol:	7.7
Dipole, Da:	2.6
IP(EA), eV:	-8.78(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-chlorophenyl)-N-[3-[(2-methoxyphenyl)sulfamoyl]-4-methylphenyl]pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)C2=C(N=C(S2)C3=CC=CC=C3Cl)C)Cl

DOS

IR

Vibrations