Geometry & MOs

Info

ID:	220459
PubChem CID:	85195426
Reduced:	OSC13H14 (1)
Stoich.:	ABC13D14 (1)
Weight, g/mol:	219.053158
ΔH_f, kcal/mol:	33.69
Dipole, Da:	1.69
IP(EA), eV:	-9.1(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-acetyl-7-methyl-4aH-pyrano[3,2-c]pyridine-2,5-dione

Drug info:

PubChemData

Smile

CCC(C=CC=CC#CC1=CC=CS1)O

DOS

IR

Vibrations