Geometry & MOs

Info

ID:	52478
PubChem CID:	12015355
Reduced:	FeNO2H17C19 (1)
Stoich.:	ABC2D17E19 (1)
Weight, g/mol:	227.094629
ΔH_f, kcal/mol:	37.52
Dipole, Da:	16.0
IP(EA), eV:	-6.65(-1.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,5R)-4-cyclopenta-2,4-dien-1-yl-5-phenyl-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

[CH-]1C=CC=C1.C1=CC=C(C=C1)[C@@H]2[C@H](NC(=O)O2)[C-]3C=CC=C3.[Fe+2]

DOS

IR

Vibrations