Geometry & MOs

Info

ID:	367445
PubChem CID:	127324628
Reduced:	FON5C19H24 (1)
Stoich.:	ABC5D19E24 (1)
Weight, g/mol:	375.18413
ΔH_f, kcal/mol:	-37.65
Dipole, Da:	6.5
IP(EA), eV:	-9.16(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=NN2CC(CCC2=N1)NC(=O)N3CCCC3C4=CC(=CC=C4)F

DOS

IR

Vibrations