Geometry & MOs

Info

ID:	348388
PubChem CID:	127273453
Reduced:	N3O3C21H23 (1)
Stoich.:	A3B3C21D23 (1)
Weight, g/mol:	359.220892
ΔH_f, kcal/mol:	-74.27
Dipole, Da:	6.34
IP(EA), eV:	-8.16(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-4-benzyl-5-oxo-N-(1-propylpiperidin-4-yl)morpholine-3-carboxamide

Drug info:

PubChemData

Smile

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)C4=CN=C(C=C4)N5CCCC5

DOS

IR

Vibrations