Geometry & MOs

Info

ID:	184411
PubChem CID:	77157748
Reduced:	O2N6C19H20 (1)
Stoich.:	A2B6C19D20 (1)
Weight, g/mol:	309.067094
ΔH_f, kcal/mol:	17.15
Dipole, Da:	3.12
IP(EA), eV:	-8.95(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[6-(furan-2-yl)pyridin-3-yl]oxythiane-3,4,5-triol

Drug info:

PubChemData

Smile

CC1(CC(=O)N(C(=N1)N)C)C2=CC(=CC=C2)NC(=O)N3CC=CC=C3C#N

DOS

IR

Vibrations