Geometry & MOs

Info

ID:	255109
PubChem CID:	103130015
Reduced:	ClFN4H14C15 (1)
Stoich.:	ABC4D14E15 (1)
Weight, g/mol:	268.143645
ΔH_f, kcal/mol:	46.2
Dipole, Da:	2.21
IP(EA), eV:	-9.02(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-pyrazolo[1,5-a]pyridin-3-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-7-yl)methanamine

Drug info:

PubChemData

Smile

C1=CC2=C(C=NN2C=C1)C(CC3=C(C(=CC=C3)Cl)F)NN

DOS

IR

Vibrations