Geometry & MOs

Info

ID:	366087
PubChem CID:	127319420
Reduced:	NSO4C19H25 (1)
Stoich.:	ABC4D19E25 (1)
Weight, g/mol:	295.087829
ΔH_f, kcal/mol:	-179.67
Dipole, Da:	4.14
IP(EA), eV:	-9.37(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothian-3-yl)-2,3-dihydro-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C=CC(=C2)C(=O)CCC(=O)NC3CCCS(=O)(=O)C3

DOS

IR

Vibrations