Geometry & MOs

Info

ID:	51306
PubChem CID:	12013952
Reduced:	ClNO4H16C20 (1)
Stoich.:	ABC4D16E20 (1)
Weight, g/mol:	351.147058
ΔH_f, kcal/mol:	-67.99
Dipole, Da:	4.29
IP(EA), eV:	-8.92(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3S,5R)-5-ethoxy-2-phenyl-1,2-oxazolidin-3-yl]-6-methylchromen-4-one

Drug info:

PubChemData

Smile

CC(=O)[C@@H]1C[C@H](N(O1)C2=CC=CC=C2)C3=COC4=C(C3=O)C=C(C=C4)Cl

DOS

IR

Vibrations