Geometry & MOs

Info

ID:	140298
PubChem CID:	52679039
Reduced:	ClSO2N4C21H23 (1)
Stoich.:	ABC2D4E21F23 (1)
Weight, g/mol:	430.123025
ΔH_f, kcal/mol:	-7.62
Dipole, Da:	8.54
IP(EA), eV:	-8.55(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-[(1-benzyl-5-chloro-3-methylpyrazol-4-yl)methyl]-2-methyl-2,3-dihydroindole-5-sulfonamide

Drug info:

PubChemData

Smile

C[C@H]1CC2=C(N1CC3=C(N(N=C3C)CC4=CC=CC=C4)Cl)C=CC(=C2)S(=O)(=O)N

DOS

IR

Vibrations