Geometry & MOs

Info

ID:	16975
PubChem CID:	481458
Reduced:	SO2N3H17C20 (1)
Stoich.:	AB2C3D17E20 (1)
Weight, g/mol:	363.104148
ΔH_f, kcal/mol:	25.08
Dipole, Da:	3.87
IP(EA), eV:	-8.4(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3-phenoxyphenyl)sulfanylmethyl]furo[2,3-b]pyridine-4,6-diamine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)OC2=CC(=CC=C2)SCC3=COC4=C3C(=CC(=N4)N)N

DOS

IR

Vibrations