Geometry & MOs

Info

ID:	222604
PubChem CID:	85305603
Reduced:	S2Se3C6H7 (1)
Stoich.:	A2B3C6D7 (1)
Weight, g/mol:	379.141973
ΔH_f, kcal/mol:	75.91
Dipole, Da:	4.39
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.879660
Charge, e:	0

Chem-info

IUPAC name:

2-[2-ethyl-1-(2-oxo-4,5-diphenyl-1,3-oxazolidin-3-yl)cyclopropyl]-2-oxoacetic acid

Drug info:

PubChemData

Smile

C1CSC2C(=[Se]C(=[Se])[Se]2)SC1

DOS

IR

Vibrations