Geometry & MOs

Info

ID:	44105
PubChem CID:	10500710
Reduced:	SN4O5C17H20 (1)
Stoich.:	AB4C5D17E20 (1)
Weight, g/mol:	392.094312
ΔH_f, kcal/mol:	-121.28
Dipole, Da:	7.33
IP(EA), eV:	-8.94(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,3-benzodioxol-5-yl)-3-methoxy-6-(pyridin-4-ylmethylsulfanyl)imidazo[1,2-b]pyridazine

Drug info:

PubChemData

Smile

CC1(OCC(O1)C=NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=C(C=N3)OC)C

DOS

IR

Vibrations