Geometry & MOs

Info

ID:	367436
PubChem CID:	127324614
Reduced:	OSN5C17H23 (1)
Stoich.:	ABC5D17E23 (1)
Weight, g/mol:	376.222289
ΔH_f, kcal/mol:	10.1
Dipole, Da:	2.48
IP(EA), eV:	-9.09(-0.16)
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-(oxolane-2-carbonyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CCC1=NN2CC(CCC2=N1)NC(=O)N3CCCC3C4=CC=CS4

DOS

IR

Vibrations