Geometry & MOs

Info

ID:	329649
PubChem CID:	126920513
Reduced:	N7C16H25 (1)
Stoich.:	A7B16C25 (1)
Weight, g/mol:	300.206245
ΔH_f, kcal/mol:	108.83
Dipole, Da:	9.04
IP(EA), eV:	-8.87(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1CCCCC1CN(C)C2CN(C2)C3=NN4C=NN=C4C=C3

DOS

IR

Vibrations