Geometry & MOs

Info

ID:	205018
PubChem CID:	80044758
Reduced:	N5C16H25 (1)
Stoich.:	A5B16C25 (1)
Weight, g/mol:	307.156373
ΔH_f, kcal/mol:	43.03
Dipole, Da:	2.27
IP(EA), eV:	-8.26(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(aminomethyl)cyclohexyl]-6-chloro-N-ethyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine

Drug info:

PubChemData

Smile

CCN(C1CCCCC1CN)C2=NN3C=CC=C(C3=N2)C

DOS

IR

Vibrations