Geometry & MOs

Info

ID:	55241
PubChem CID:	17389942
Reduced:	BrClNOC13H19 (1)
Stoich.:	ABCDE13F19 (1)
Weight, g/mol:	241.123342
ΔH_f, kcal/mol:	-73.95
Dipole, Da:	5.73
IP(EA), eV:	-9.27(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methoxy-3-methylphenyl)piperidine;hydrochloride

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations