Geometry & MOs

Info

ID:	361133
PubChem CID:	127302077
Reduced:	SO3N4C13H14 (1)
Stoich.:	AB3C4D13E14 (1)
Weight, g/mol:	385.182398
ΔH_f, kcal/mol:	-60.04
Dipole, Da:	6.32
IP(EA), eV:	-8.99(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-cyclohexyl-1,3-thiazol-2-yl)ethyl]-3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxamide

Drug info:

PubChemData

Smile

C1CS(=O)(=O)CC1C(=O)NC2=CC=C(C=C2)C3=NC=NN3

DOS

IR

Vibrations