Geometry & MOs

Info

ID:	68023
PubChem CID:	46507620
Reduced:	ClSN2O3H13C19 (1)
Stoich.:	ABC2D3E13F19 (1)
Weight, g/mol:	328.085935
ΔH_f, kcal/mol:	20.58
Dipole, Da:	2.6
IP(EA), eV:	-8.87(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-fluorophenyl)-5-(hydroxymethyl)-8-methyl-2-oxopyrano[2,3-c]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=CC2=C1O/C(=N\O)/C(=C2)C3=NC(=CS3)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations