Geometry & MOs

Info

ID:	129573
PubChem CID:	51073156
Reduced:	OSN3C11H15 (1)
Stoich.:	ABC3D11E15 (1)
Weight, g/mol:	279.050004
ΔH_f, kcal/mol:	2.05
Dipole, Da:	1.87
IP(EA), eV:	-9.82(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-N-(1,3,4-thiadiazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Drug info:

PubChemData

Smile

C1CC2CC1CC2CC(=O)NC3=NN=CS3

DOS

IR

Vibrations