Geometry & MOs

Info

ID:	54428
PubChem CID:	17388664
Reduced:	O4C23H32 (1)
Stoich.:	A4B23C32 (1)
Weight, g/mol:	283.089455
ΔH_f, kcal/mol:	-172.62
Dipole, Da:	2.48
IP(EA), eV:	-9.43(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloroethyl-dimethyl-(naphthalen-1-ylmethyl)azanium;chloride

Drug info:

PubChemData

Smile

CC(=O)[C@]12C(O1)CC3C2(CCC4C3CC=C5C4(CCC(C5)OC(=O)C)C)C

DOS

IR

Vibrations