Geometry & MOs

Info

ID:	31086
PubChem CID:	854451
Reduced:	N5C20H21 (1)
Stoich.:	A5B20C21 (1)
Weight, g/mol:	259.110947
ΔH_f, kcal/mol:	112.93
Dipole, Da:	4.69
IP(EA), eV:	-8.2(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1H-benzimidazol-2-yl)-2-methylquinoline

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=C[C@@H](N3C(=NC=N3)N2)C4=CC=C(C=C4)N(C)C

DOS

IR

Vibrations