Geometry & MOs

Info

ID:	263868
PubChem CID:	103402891
Reduced:	ClSN2O2H11C14 (1)
Stoich.:	ABC2D2E11F14 (1)
Weight, g/mol:	301.090328
ΔH_f, kcal/mol:	-18.15
Dipole, Da:	2.67
IP(EA), eV:	-9.39(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-[(1-hydroxy-3-methylcyclohexyl)methyl]-4-methylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CSC(=C1Cl)C2=NC3=CC=CC=C3N2CC(=O)O

DOS

IR

Vibrations