Geometry & MOs

Info

ID:	191479
PubChem CID:	78150759
Reduced:	N2O6C19H26 (1)
Stoich.:	A2B6C19D26 (1)
Weight, g/mol:	454.210387
ΔH_f, kcal/mol:	-233.31
Dipole, Da:	2.19
IP(EA), eV:	-8.95(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[3-(hydroxymethyl)-4-(oxan-4-yl)-5-oxomorpholin-2-yl]phenyl]-2-(4-methoxyphenyl)acetamide

Drug info:

PubChemData

Smile

COCC(=O)NC1=CC=C(C=C1)C2C(N(C(=O)CO2)C3CCOCC3)CO

DOS

IR

Vibrations