Geometry & MOs

Info

ID:	391722
PubChem CID:	135008895
Reduced:	ISeSiN2O2C24H35 (1)
Stoich.:	ABCD2E2F24G35 (1)
Weight, g/mol:	292.142307
ΔH_f, kcal/mol:	-77.89
Dipole, Da:	3.75
IP(EA), eV:	-8.74(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aR,7aR)-2-methyl-4-[(4S)-2-oxo-4-propan-2-yl-1,3-oxazolidin-3-yl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Drug info:

PubChemData

Smile

CCC1([C@@H]2[C@H](C(=O)N2C(=NC3=CC=C(C=C3)C)[Se]1)[C@@H](C)O[Si](C)(C)C(C)(C)C)C(=C)I

DOS

IR

Vibrations