Geometry & MOs

Info

ID:	367160
PubChem CID:	127323576
Reduced:	ON6C17H26 (1)
Stoich.:	AB6C17D26 (1)
Weight, g/mol:	317.131031
ΔH_f, kcal/mol:	-2.59
Dipole, Da:	3.58
IP(EA), eV:	-9.22(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-N-(2-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CCC1=NN2CC(CCC2=N1)NC(=O)C(C)C3=C(N(N=C3C)C)C

DOS

IR

Vibrations