Geometry & MOs

Info

ID:	30680
PubChem CID:	841714
Reduced:	FNSO3C17H20 (1)
Stoich.:	ABCD3E17F20 (1)
Weight, g/mol:	346.135114
ΔH_f, kcal/mol:	-136.78
Dipole, Da:	5.16
IP(EA), eV:	-8.38(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-carbamoyl-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-2,5-dimethylfuran-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=C(C=C1)OC)NS(=O)(=O)C2=CC=C(C=C2)F

DOS

IR

Vibrations