Geometry & MOs

Info

ID:	51286
PubChem CID:	12013931
Reduced:	NO4H19C20 (1)
Stoich.:	AB4C19D20 (1)
Weight, g/mol:	365.162708
ΔH_f, kcal/mol:	-72.68
Dipole, Da:	3.27
IP(EA), eV:	-8.55(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3S,5R)-5-(2-methylpropoxy)-2-phenyl-1,2-oxazolidin-3-yl]chromen-4-one

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations