Geometry & MOs

Info

ID:	129334
PubChem CID:	51072291
Reduced:	SCl2N2O3H4C7 (1)
Stoich.:	AB2C2D3E4F7 (1)
Weight, g/mol:	209.116427
ΔH_f, kcal/mol:	-98.37
Dipole, Da:	4.84
IP(EA), eV:	-9.83(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

C1=C2C(=CC(=C1S(=O)(=O)Cl)Cl)NC(=O)N2

DOS

IR

Vibrations