Geometry & MOs

Info

ID:	268319
PubChem CID:	103598907
Reduced:	FON3H14C15 (1)
Stoich.:	ABC3D14E15 (1)
Weight, g/mol:	259.077933
ΔH_f, kcal/mol:	-9.41
Dipole, Da:	5.8
IP(EA), eV:	-9.5(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)-3-thiophen-2-ylprop-2-en-1-one

Drug info:

PubChemData

Smile

C1CN(CC2=C1NN=C2)C(=O)C=CC3=CC(=CC=C3)F

DOS

IR

Vibrations