Geometry & MOs

Info

ID:	367511
PubChem CID:	127324848
Reduced:	ON4C11H14 (1)
Stoich.:	AB4C11D14 (1)
Weight, g/mol:	387.263425
ΔH_f, kcal/mol:	77.44
Dipole, Da:	3.26
IP(EA), eV:	-9.65(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[4-[methyl-(6-methylpyridazin-3-yl)amino]piperidin-1-yl]-1-oxopropan-2-yl]cyclohexanecarboxamide

Drug info:

PubChemData

Smile

C1CC1CCC2=NC(=NO2)CN3C=CC=N3

DOS

IR

Vibrations