Geometry & MOs

Info

ID:	208347
PubChem CID:	80522111
Reduced:	SN2O2C10H22 (1)
Stoich.:	AB2C2D10E22 (1)
Weight, g/mol:	290.077931
ΔH_f, kcal/mol:	-105.48
Dipole, Da:	5.98
IP(EA), eV:	-8.82(1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-pyridin-2-yl-5-(2,4,6-trifluorophenyl)-1H-pyrazol-3-amine

Drug info:

PubChemData

Smile

CC(C)N(C)CCC1CS(=O)(=O)CCN1

DOS

IR

Vibrations