Geometry & MOs

Info

ID:	65112
PubChem CID:	29204485
Reduced:	SN4O5C21H26 (1)
Stoich.:	AB4C5D21E26 (1)
Weight, g/mol:	494.094617
ΔH_f, kcal/mol:	-93.66
Dipole, Da:	8.03
IP(EA), eV:	-9.18(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-1-[(2-chlorophenyl)methyl]-N-[3-(diethylsulfamoyl)phenyl]-3-methylpyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3

DOS

IR

Vibrations