Geometry & MOs

Info

ID:	329648
PubChem CID:	126920511
Reduced:	N7C15H17 (1)
Stoich.:	A7B15C17 (1)
Weight, g/mol:	315.217144
ΔH_f, kcal/mol:	155.79
Dipole, Da:	7.32
IP(EA), eV:	-9.42(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[(1-methylpiperidin-2-yl)methyl]-1-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)azetidin-3-amine

Drug info:

PubChemData

Smile

CN(CC1=CN=CC=C1)C2CN(C2)C3=NN4C=NN=C4C=C3

DOS

IR

Vibrations