Geometry & MOs

Info

ID:	23071
PubChem CID:	601541
Reduced:	O5C12H12 (1)
Stoich.:	A5B12C12 (1)
Weight, g/mol:	236.068473
ΔH_f, kcal/mol:	-180.2
Dipole, Da:	6.98
IP(EA), eV:	-9.91(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-2-methyl-7-prop-1-enyl-2,3-dihydropyrano[3,2-c]pyran-4,5-dione

Drug info:

PubChemData

Smile

CC=CC1=CC2=C(C(=O)C(C(O2)C)O)C(=O)O1

DOS

IR

Vibrations