Geometry & MOs

Info

ID:	422566
PubChem CID:	135118049
Reduced:	NO4C21H29 (1)
Stoich.:	AB4C21D29 (1)
Weight, g/mol:	331.189592
ΔH_f, kcal/mol:	-173.55
Dipole, Da:	4.07
IP(EA), eV:	-9.45(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R,6S)-6-[4-(methylaminomethyl)piperidine-1-carbonyl]-5-phenylmorpholin-3-one

Drug info:

PubChemData

Smile

CC1(C(C1(C)C)C(=O)N2CC[C@]([C@H](C2)O)(CC3=CC=CC=C3)C(=O)O)C

DOS

IR

Vibrations