Geometry & MOs

Info

ID:	140903
PubChem CID:	52781236
Reduced:	ClN2O3C17H23 (1)
Stoich.:	AB2C3D17E23 (1)
Weight, g/mol:	338.13972
ΔH_f, kcal/mol:	-117.68
Dipole, Da:	3.64
IP(EA), eV:	-8.97(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-[(2S)-2-(4-chlorophenyl)-2-morpholin-4-ylethyl]oxolane-3-carboxamide

Drug info:

PubChemData

Smile

C1COC[C@@H]1C(=O)NC[C@@H](C2=CC=C(C=C2)Cl)N3CCOCC3

DOS

IR

Vibrations