Geometry & MOs

Info

ID:	135456
PubChem CID:	51873791
Reduced:	N2O3C19H28 (1)
Stoich.:	A2B3C19D28 (1)
Weight, g/mol:	332.209993
ΔH_f, kcal/mol:	-133.08
Dipole, Da:	1.08
IP(EA), eV:	-9.35(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S,3S)-1-[(2R)-2-ethylmorpholin-4-yl]-3-methyl-1-oxopentan-2-yl]benzamide

Drug info:

PubChemData

Smile

CC[C@@H]1CN(CCO1)C(=O)[C@@H]([C@@H](C)CC)NC(=O)C2=CC=CC=C2

DOS

IR

Vibrations