Geometry & MOs

Info

ID:	234287
PubChem CID:	92298101
Reduced:	NSO3C11H17 (1)
Stoich.:	ABC3D11E17 (1)
Weight, g/mol:	286.058971
ΔH_f, kcal/mol:	-109.42
Dipole, Da:	5.85
IP(EA), eV:	-9.78(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3E)-6-ethyl-3-hydroxyiminopyrano[3,2-c]quinoline-2,4,5-trione

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)S(=O)(=O)N[C@H](C)COC

DOS

IR

Vibrations