Geometry & MOs

Info

ID:	54433
PubChem CID:	17388672
Reduced:	BrClNC11H21 (1)
Stoich.:	ABCD11E21 (1)
Weight, g/mol:	337.159727
ΔH_f, kcal/mol:	-6.46
Dipole, Da:	12.4
IP(EA), eV:	-7.89(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl-(naphthalen-1-ylmethyl)-[(E)-3-phenylprop-2-enyl]azanium;chloride

Drug info:

PubChemData

Smile

CC[N+](CC)(CC=C)C/C=C(\C)/Cl.[Br-]

DOS

IR

Vibrations