Geometry & MOs

Info

ID:	320729
PubChem CID:	126663128
Reduced:	N2H12C17 (2)
Stoich.:	A2B12C17 (2)
Weight, g/mol:	358.190595
ΔH_f, kcal/mol:	181.39
Dipole, Da:	3.09
IP(EA), eV:	-7.91(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2E)-2-(5-tert-butyl-1,2-dihydropyrazol-3-ylidene)benzimidazol-5-yl]-2-(methylideneamino)aniline

Drug info:

PubChemData

Smile

C1C(=CC=C(N1)C2=NC=C(C=C2)N3C4=CC=CC=C4C5=CC=CC=C53)N6C7=CC=CC=C7C8=CC=CC=C86

DOS

IR

Vibrations