Geometry & MOs

Info

ID:	140902
PubChem CID:	52781235
Reduced:	ClN2O3C17H23 (1)
Stoich.:	AB2C3D17E23 (1)
Weight, g/mol:	338.13972
ΔH_f, kcal/mol:	-117.86
Dipole, Da:	1.41
IP(EA), eV:	-9.03(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-[(2R)-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