Geometry & MOs

Info

ID:	328879
PubChem CID:	126728625
Reduced:	S2N3O4H15C25 (1)
Stoich.:	A2B3C4D15E25 (1)
Weight, g/mol:	173.084064
ΔH_f, kcal/mol:	5.74
Dipole, Da:	3.08
IP(EA), eV:	-8.66(-1.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-5-(3-methylfuran-2-yl)pyridine

Drug info:

PubChemData

Smile

C1=CN=C(C=C1/C=C/C2=C3C=CSC3=CS2)C4=NC(=CC(=C4)C(=O)O)C5=NC=CC(=C5)C(=O)O

DOS

IR

Vibrations