Geometry & MOs

Info

ID:	329673
PubChem CID:	126920587
Reduced:	N8C17H22 (1)
Stoich.:	A8B17C22 (1)
Weight, g/mol:	340.176007
ΔH_f, kcal/mol:	156.92
Dipole, Da:	12.24
IP(EA), eV:	-9.11(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-ylmethyl)-N-methyl-1-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)azetidin-3-amine

Drug info:

PubChemData

Smile

CN(CC1=NN2CCCCC2=C1)C3CN(C3)C4=NN5C=NN=C5C=C4

DOS

IR

Vibrations