Geometry & MOs

Info

ID:	304018
PubChem CID:	124491361
Reduced:	NOC9H13 (2)
Stoich.:	ABC9D13 (2)
Weight, g/mol:	302.199428
ΔH_f, kcal/mol:	-79.4
Dipole, Da:	3.1
IP(EA), eV:	-8.96(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-1-morpholin-4-yl-3-phenyl-3-piperidin-4-ylpropan-1-one

Drug info:

PubChemData

Smile

C1C[C@H](CNC1)[C@@H](CC(=O)N2CCOCC2)C3=CC=CC=C3

DOS

IR

Vibrations