Geometry & MOs

Info

ID:	64979
PubChem CID:	29204285
Reduced:	OCl3N4H15C18 (1)
Stoich.:	AB3C4D15E18 (1)
Weight, g/mol:	471.042043
ΔH_f, kcal/mol:	30.54
Dipole, Da:	3.42
IP(EA), eV:	-9.35(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-3-pyridin-3-yl-N'-(2,4,6-trichlorophenyl)pyrazole-4-carbohydrazide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NNC3=C(C=C(C=C3Cl)Cl)Cl

DOS

IR

Vibrations