Geometry & MOs

Info

ID:	55242
PubChem CID:	17389944
Reduced:	ClNOC13H20 (1)
Stoich.:	ABCD13E20 (1)
Weight, g/mol:	280.030082
ΔH_f, kcal/mol:	-66.99
Dipole, Da:	2.05
IP(EA), eV:	-8.82(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dichloro-N-(pyrrolidin-2-ylmethyl)aniline;hydrochloride

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C2CCCCN2)OC.Cl

DOS

IR

Vibrations