Geometry & MOs

Info

ID:	28201
PubChem CID:	826239
Reduced:	ClNOC19H22 (1)
Stoich.:	ABCD19E22 (1)
Weight, g/mol:	323.188529
ΔH_f, kcal/mol:	-11.21
Dipole, Da:	4.66
IP(EA), eV:	-9.04(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-(4-methoxyphenyl)-2-phenyl-3-piperidin-1-ylpropan-1-one

Drug info:

PubChemData

Smile

C1CCN(CC1)[C@H](C2=CC=CC=C2)[C@@H](C3=CC=C(C=C3)Cl)O

DOS

IR

Vibrations