Geometry & MOs

Info

ID:	183925
PubChem CID:	77090390
Reduced:	SN3O3C14H21 (1)
Stoich.:	AB3C3D14E21 (1)
Weight, g/mol:	307.129632
ΔH_f, kcal/mol:	-103.88
Dipole, Da:	6.98
IP(EA), eV:	-9.85(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopropyl-5-[(2,3,4-trifluorophenyl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine

Drug info:

PubChemData

Smile

CN(CC1=CC=NC=C1)CC(=O)NCC2CCS(=O)(=O)C2

DOS

IR

Vibrations