Geometry & MOs

Info

ID:	65168
PubChem CID:	29204559
Reduced:	SN4O4H22C24 (1)
Stoich.:	AB4C4D22E24 (1)
Weight, g/mol:	417.099252
ΔH_f, kcal/mol:	-40.13
Dipole, Da:	9.92
IP(EA), eV:	-8.11(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(4-chlorobenzoyl)-1-phenyl-3-pyridin-3-ylpyrazole-4-carbohydrazide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)C2=CN(N=C2)C3=CC=CC=C3)S(=O)(=O)NC4=CC=C(C=C4)OC

DOS

IR

Vibrations