Geometry & MOs

Info

ID:	247977
PubChem CID:	103077898
Reduced:	ClN2C5H5 (2)
Stoich.:	AB2C5D5 (2)
Weight, g/mol:	264.137497
ΔH_f, kcal/mol:	53.04
Dipole, Da:	3.7
IP(EA), eV:	-8.57(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-N-(2-phenylphenyl)pyrazole-3,4-diamine

Drug info:

PubChemData

Smile

CN1C=C(C(=N1)NC2=C(C=CC(=C2)Cl)Cl)N

DOS

IR

Vibrations