Geometry & MOs

Info

ID:	276089
PubChem CID:	103820465
Reduced:	NO2S2C14H21 (1)
Stoich.:	AB2C2D14E21 (1)
Weight, g/mol:	293.14495
ΔH_f, kcal/mol:	-89.75
Dipole, Da:	5.4
IP(EA), eV:	-8.29(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-hydroxycyclohexyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-4-carboxamide

Drug info:

PubChemData

Smile

CC(CNC(=O)C1CCCC2=C1C=CS2)(CSC)O

DOS

IR

Vibrations