Geometry & MOs

Info

ID:	293411
PubChem CID:	117387960
Reduced:	ClNOC14H20 (1)
Stoich.:	ABCD14E20 (1)
Weight, g/mol:	253.123342
ΔH_f, kcal/mol:	-44.37
Dipole, Da:	3.73
IP(EA), eV:	-8.58(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-chloro-4-ethyl-5-methoxyphenyl)piperidine

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1OC)C2CCNCC2)Cl)C

DOS

IR

Vibrations