Geometry & MOs

Info

ID:	157421
PubChem CID:	56424102
Reduced:	OSCl2N3H11C12 (1)
Stoich.:	ABC2D3E11F12 (1)
Weight, g/mol:	342.103814
ΔH_f, kcal/mol:	3.47
Dipole, Da:	1.2
IP(EA), eV:	-8.39(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-ethoxy-N-(6-methylsulfanylpyridin-3-yl)-2H-chromene-3-carboxamide

Drug info:

PubChemData

Smile

CN1C(=CC(=C1Cl)Cl)C(=O)NC2=CN=C(C=C2)SC

DOS

IR

Vibrations