Geometry & MOs

Info

ID:	200460
PubChem CID:	79391103
Reduced:	NO2C15H29 (1)
Stoich.:	AB2C15D29 (1)
Weight, g/mol:	246.068766
ΔH_f, kcal/mol:	-135.87
Dipole, Da:	1.06
IP(EA), eV:	-8.99(0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-4-(6-methyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-1,2-thiazol-5-amine

Drug info:

PubChemData

Smile

CCC1CCC(CC1)CNC(C)C(C)C(=O)OC

DOS

IR

Vibrations