Geometry & MOs

Info

ID:	80073
PubChem CID:	49832672
Reduced:	SN2O4C12H12 (1)
Stoich.:	AB2C4D12E12 (1)
Weight, g/mol:	262.041213
ΔH_f, kcal/mol:	-101.89
Dipole, Da:	4.19
IP(EA), eV:	-9.42(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-methyl-1,3-thiazol-2-yl)-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione

Drug info:

PubChemData

Smile

CC1=CN=C(S1)NC(=O)C2C3C=CC(C2C(=O)O)O3

DOS

IR

Vibrations