Geometry & MOs

Info

ID:	178966
PubChem CID:	76410660
Reduced:	N2O5C21H24 (1)
Stoich.:	A2B5C21D24 (1)
Weight, g/mol:	446.184172
ΔH_f, kcal/mol:	-164.2
Dipole, Da:	1.47
IP(EA), eV:	-8.91(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(4-benzyl-5-oxomorpholin-3-yl)-hydroxymethyl]phenyl]-2-phenoxyacetamide

Drug info:

PubChemData

Smile

COCC(=O)NC1=CC=C(C=C1)C(C2COCC(=O)N2CC3=CC=CC=C3)O

DOS

IR

Vibrations