Geometry & MOs

Info

ID:	51296
PubChem CID:	12013941
Reduced:	NO4H17C20 (1)
Stoich.:	AB4C17D20 (1)
Weight, g/mol:	336.111007
ΔH_f, kcal/mol:	-59.56
Dipole, Da:	1.66
IP(EA), eV:	-8.91(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,5R)-3-(4-oxochromen-3-yl)-2-phenyl-1,2-oxazolidine-5-carboxamide

Drug info:

PubChemData

Smile

CC(=O)[C@H]1C[C@H](N(O1)C2=CC=CC=C2)C3=COC4=CC=CC=C4C3=O

DOS

IR

Vibrations