Geometry & MOs

Info

ID:	271627
PubChem CID:	103686116
Reduced:	NO2S2C16H19 (1)
Stoich.:	AB2C2D16E19 (1)
Weight, g/mol:	305.054421
ΔH_f, kcal/mol:	-46.42
Dipole, Da:	4.4
IP(EA), eV:	-8.69(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-2-thiophen-3-ylethyl)-2,3-dihydro-1-benzothiophene-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)SCCCC(=O)NCC(C2=CSC=C2)O

DOS

IR

Vibrations