Geometry & MOs

Info

ID:	20045
PubChem CID:	577577
Reduced:	O4H10C11 (1)
Stoich.:	A4B10C11 (1)
Weight, g/mol:	206.057909
ΔH_f, kcal/mol:	-144.32
Dipole, Da:	7.68
IP(EA), eV:	-9.75(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-4-oxo-2,3-dihydrochromene-5-carboxylic acid

Drug info:

PubChemData

Smile

CC1CC(=O)C2=C(C=CC=C2O1)C(=O)O

DOS

IR

Vibrations