Geometry & MOs

Info

ID:	366209
PubChem CID:	127319642
Reduced:	NSO5C16H19 (1)
Stoich.:	ABC5D16E19 (1)
Weight, g/mol:	335.119129
ΔH_f, kcal/mol:	-181.13
Dipole, Da:	2.8
IP(EA), eV:	-8.66(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6,7-dimethyl-1-benzofuran-3-yl)-N-(1,1-dioxothian-3-yl)acetamide

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)C(=CO2)CC(=O)NC3CCCS(=O)(=O)C3

DOS

IR

Vibrations