Geometry & MOs

Info

ID:	145964
PubChem CID:	53618672
Reduced:	ON4C18H22 (1)
Stoich.:	AB4C18D22 (1)
Weight, g/mol:	332.14193
ΔH_f, kcal/mol:	9.1
Dipole, Da:	2.37
IP(EA), eV:	-9.49(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-ethylthiadiazol-5-yl)-[4-[methyl(pyridazin-3-yl)amino]piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC(C)C1=NN=C2N1CCN(C2)C(=O)C3=CC4=C(CCC4)C=C3

DOS

IR

Vibrations