Geometry & MOs

Info

ID:	237208
PubChem CID:	92717904
Reduced:	ON2C7H12 (1)
Stoich.:	AB2C7D12 (1)
Weight, g/mol:	294.078662
ΔH_f, kcal/mol:	-8.14
Dipole, Da:	3.56
IP(EA), eV:	-9.63(1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3aS,7aS)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]-N-(1,3,4-thiadiazol-2-yl)acetamide

Drug info:

PubChemData

Smile

C1CC1C(=O)N[C@@H]2C[C@@H]2N

DOS

IR

Vibrations