Geometry & MOs

Info

ID:	55240
PubChem CID:	17389941
Reduced:	ClNOC13H18 (1)
Stoich.:	ABCD13E18 (1)
Weight, g/mol:	319.03385
ΔH_f, kcal/mol:	-39.21
Dipole, Da:	4.45
IP(EA), eV:	-8.64(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-bromo-2-ethoxyphenyl)piperidine;hydrochloride

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)Cl)C2CCCCN2

DOS

IR

Vibrations