Geometry & MOs

Info

ID:	396794
PubChem CID:	135029232
Reduced:	N2H12C15 (1)
Stoich.:	A2B12C15 (1)
Weight, g/mol:	221.107873
ΔH_f, kcal/mol:	95.13
Dipole, Da:	2.81
IP(EA), eV:	-7.8(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(2E)-2-(pyridin-1-ium-1-ylmethylidene)-1H-quinoline

Drug info:

PubChemData

Smile

C1=CC=[N+](C=C1)/C=C/2\C=CC3=CC=CC=C3[N-]2

DOS

IR

Vibrations