Geometry & MOs

Info

ID:	205082
PubChem CID:	80052789
Reduced:	ON5C12H13 (1)
Stoich.:	AB5C12D13 (1)
Weight, g/mol:	320.06366
ΔH_f, kcal/mol:	81.77
Dipole, Da:	2.73
IP(EA), eV:	-8.79(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bicyclo[2.2.1]heptanylmethyl)-8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-amine

Drug info:

PubChemData

Smile

CC1=CC2=NC(=NN2C=C1)NCC3=NOC(=C3)C

DOS

IR

Vibrations