Geometry & MOs

Info

ID:	77356
PubChem CID:	48426247
Reduced:	NO2C10H15 (2)
Stoich.:	AB2C10D15 (2)
Weight, g/mol:	322.171499
ΔH_f, kcal/mol:	-156.85
Dipole, Da:	3.25
IP(EA), eV:	-8.41(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-2-oxoethyl]-5-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCCCOC1=C(C=C(C=C1)/C=C/C(=O)NCC(=O)N(CC)CC)OC

DOS

IR

Vibrations