Geometry & MOs

Info

ID:	293983
PubChem CID:	117420806
Reduced:	ClO2C15H19 (1)
Stoich.:	AB2C15D19 (1)
Weight, g/mol:	266.118591
ΔH_f, kcal/mol:	-102.47
Dipole, Da:	4.52
IP(EA), eV:	-8.95(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-1-(3-chloro-4-piperidin-1-ylphenyl)propan-1-one

Drug info:

PubChemData

Smile

CC1=C2CCCCC2=C(C(=C1C(C)CC=O)O)Cl

DOS

IR

Vibrations