Geometry & MOs

Info

ID:	51305
PubChem CID:	12013951
Reduced:	ClNO4H16C20 (1)
Stoich.:	ABC4D16E20 (1)
Weight, g/mol:	369.076786
ΔH_f, kcal/mol:	-67.75
Dipole, Da:	3.03
IP(EA), eV:	-8.98(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3S,5S)-5-acetyl-2-phenyl-1,2-oxazolidin-3-yl]-6-chlorochromen-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