Geometry & MOs

Info

ID:	237237
PubChem CID:	92717979
Reduced:	OSN3H10C11 (2)
Stoich.:	ABC3D10E11 (2)
Weight, g/mol:	375.088892
ΔH_f, kcal/mol:	73.76
Dipole, Da:	4.71
IP(EA), eV:	-8.57(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 2-[(3aS,7aR)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]acetate

Drug info:

PubChemData

Smile

C1C[C@@H](OC1)CN2C(=C3C=NC4=CC=CC=C43)NN=C2SCC5=NC(=O)C6=C(N5)C=CS6

DOS

IR

Vibrations