Geometry & MOs

Info

ID:	205042
PubChem CID:	80047769
Reduced:	N2C7H10 (2)
Stoich.:	A2B7C10 (2)
Weight, g/mol:	277.109423
ΔH_f, kcal/mol:	46.72
Dipole, Da:	2.06
IP(EA), eV:	-8.44(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-azabicyclo[2.2.2]octan-3-yl)-6-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-amine

Drug info:

PubChemData

Smile

CC1=CN2C(=NC(=N2)NCCC3CCCC3)C=C1

DOS

IR

Vibrations