Geometry & MOs

Info

ID:	168708
PubChem CID:	75005943
Reduced:	I2O4C39H72 (1)
Stoich.:	A2B4C39D72 (1)
Weight, g/mol:	338.118591
ΔH_f, kcal/mol:	-279.41
Dipole, Da:	3.78
IP(EA), eV:	-9.49(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-methyl-4-(2-naphthalen-1-ylethenyl)pyridin-1-ium-2-yl]acetamide;chloride

Drug info:

PubChemData

Smile

CC(CCCCCCCCCCCCCCC=CI)CC(=O)O.C(CCCCCCCCC(=O)O)CCCCCCCC=CI

DOS

IR

Vibrations