Geometry & MOs

Info

ID:	145946
PubChem CID:	53617536
Reduced:	ON5C17H23 (1)
Stoich.:	AB5C17D23 (1)
Weight, g/mol:	271.179696
ΔH_f, kcal/mol:	18.39
Dipole, Da:	2.41
IP(EA), eV:	-9.01(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-propan-2-yl-N-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine

Drug info:

PubChemData

Smile

CC(C)C1=NC(=NN1)NC(=O)C2CCCN2CC3=CC=CC=C3

DOS

IR

Vibrations