Geometry & MOs

Info

ID:	329670
PubChem CID:	126920577
Reduced:	ON7C17H25 (1)
Stoich.:	AB7C17D25 (1)
Weight, g/mol:	324.181093
ΔH_f, kcal/mol:	66.81
Dipole, Da:	10.1
IP(EA), eV:	-9.2(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-ylmethyl)-N-methyl-1-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)azetidin-3-amine

Drug info:

PubChemData

Smile

CN1C(CCCCC1=O)CN(C)C2CN(C2)C3=NN4C=NN=C4C=C3

DOS

IR

Vibrations