Geometry & MOs

Info

ID:	173522
PubChem CID:	75648643
Reduced:	ClN4H21C22 (1)
Stoich.:	AB4C21D22 (1)
Weight, g/mol:	403.192272
ΔH_f, kcal/mol:	115.23
Dipole, Da:	7.98
IP(EA), eV:	-8.45(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]methylidene-pyridin-2-ylazanium

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)C(=NC2=CC=CC=C2)NN=CC3=CC=C(C=C3)Cl

DOS

IR

Vibrations