Geometry & MOs

Info

ID:	367313
PubChem CID:	127324092
Reduced:	ON6C15H24 (1)
Stoich.:	AB6C15D24 (1)
Weight, g/mol:	306.12628
ΔH_f, kcal/mol:	7.89
Dipole, Da:	5.33
IP(EA), eV:	-9.09(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCN2C(=NN=C2CNC(=O)NC3CCN(C3)C4CC4)C1

DOS

IR

Vibrations