Geometry & MOs

Info

ID:	246851
PubChem CID:	103065116
Reduced:	N2S2O3C11H18 (1)
Stoich.:	A2B2C3D11E18 (1)
Weight, g/mol:	308.06532
ΔH_f, kcal/mol:	-91.62
Dipole, Da:	7.95
IP(EA), eV:	-8.59(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-6-methoxy-N-(thiolan-3-yl)-1-benzothiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCNCC1=CC=C(O1)S(=O)(=O)NC2CCSC2

DOS

IR

Vibrations