Geometry & MOs

Info

ID:	14178
PubChem CID:	405839
Reduced:	ClNC15H15 (1)
Stoich.:	ABC15D15 (1)
Weight, g/mol:	244.089302
ΔH_f, kcal/mol:	50.69
Dipole, Da:	4.2
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.264357
Charge, e:	1

Chem-info

IUPAC name:

(3-chloro-3-naphthalen-2-ylprop-2-enylidene)-dimethylazanium

Drug info:

PubChemData

Smile

C[N+](=CC=C(C1=CC2=CC=CC=C2C=C1)Cl)C

DOS

IR

Vibrations