Geometry & MOs

Info

ID:	218672
PubChem CID:	85089790
Reduced:	N2O6H22C29 (1)
Stoich.:	A2B6C22D29 (1)
Weight, g/mol:	494.184172
ΔH_f, kcal/mol:	-97.46
Dipole, Da:	5.44
IP(EA), eV:	-8.71(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 3-[(5-hydroxypyridin-2-yl)methyl]-2-oxo-5,6-diphenylmorpholine-4-carboxylate

Drug info:

PubChemData

Smile

CC(=O)OC(C#CC1=CC=CC=C1)C2C(C(=O)N2C3=CC=C(C=C3)OC)N4C(=O)C5=CC=CC=C5C4=O

DOS

IR

Vibrations