Geometry & MOs

Info

ID:	397328
PubChem CID:	135030053
Reduced:	NO2C11H13 (1)
Stoich.:	AB2C11D13 (1)
Weight, g/mol:	335.113313
ΔH_f, kcal/mol:	-30.73
Dipole, Da:	3.75
IP(EA), eV:	-9.2(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S,6S)-4-benzyl-6-phenyl-5-(trifluoromethyl)morpholin-2-one

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C(=O)N1OC)C

DOS

IR

Vibrations