Geometry & MOs

Info

ID:	365554
PubChem CID:	127318019
Reduced:	ON5C17H27 (1)
Stoich.:	AB5C17D27 (1)
Weight, g/mol:	334.24811
ΔH_f, kcal/mol:	-18.61
Dipole, Da:	7.24
IP(EA), eV:	-8.6(0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2-ethylpiperidin-1-yl)ethyl]-3-(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)urea

Drug info:

PubChemData

Smile

C1CCN2C=C(N=C2C1)CNC(=O)N3CCN(CC3)C4CCC4

DOS

IR

Vibrations