Geometry & MOs

Info

ID:	371470
PubChem CID:	127346534
Reduced:	O2N3C20H25 (1)
Stoich.:	A2B3C20D25 (1)
Weight, g/mol:	295.087829
ΔH_f, kcal/mol:	-57.47
Dipole, Da:	5.45
IP(EA), eV:	-8.99(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxo-2,3-dihydro-1-benzothiophen-3-yl)-2-(oxolan-3-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2=CN=C(N2)C3CCCN3C(=O)CC4CCOC4

DOS

IR

Vibrations