Geometry & MOs

Info

ID:	203286
PubChem CID:	79808181
Reduced:	ClNS2O4C12H16 (1)
Stoich.:	ABC2D4E12F16 (1)
Weight, g/mol:	281.14495
ΔH_f, kcal/mol:	-161.25
Dipole, Da:	8.32
IP(EA), eV:	-9.87(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-hydroxy-4,4-dimethylcyclohexyl)methyl]-4-methylthiophene-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC=C1C(=O)NCC2CCOCC2)S(=O)(=O)Cl

DOS

IR

Vibrations