Geometry & MOs

Info

ID:	246843
PubChem CID:	103065070
Reduced:	SN2O2C13H22 (1)
Stoich.:	AB2C2D13E22 (1)
Weight, g/mol:	282.140199
ΔH_f, kcal/mol:	-116.59
Dipole, Da:	3.8
IP(EA), eV:	-8.72(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-propan-2-yl-2-(thiolan-3-yl)-6,7,8,8a-tetrahydro-3H-pyrrolo[1,2-a]pyrazine-1,4-dione

Drug info:

PubChemData

Smile

CC(C)C1C(=O)NC(C(=O)N1C2CCSC2)(C)C

DOS

IR

Vibrations