Geometry & MOs

Info

ID:	51293
PubChem CID:	12013938
Reduced:	NO3H19C24 (1)
Stoich.:	AB3C19D24 (1)
Weight, g/mol:	351.110673
ΔH_f, kcal/mol:	6.23
Dipole, Da:	2.83
IP(EA), eV:	-8.77(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1[C@H](N(O[C@H]1C2=CC=CC=C2)C3=CC=CC=C3)C4=COC5=CC=CC=C5C4=O

DOS

IR

Vibrations