Geometry & MOs

Info

ID:	47943
PubChem CID:	10535950
Reduced:	O2C5H7 (2)
Stoich.:	A2B5C7 (2)
Weight, g/mol:	198.125594
ΔH_f, kcal/mol:	-10.2
Dipole, Da:	4.94
IP(EA), eV:	-8.86(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-3-oxonon-8-enoic acid

Drug info:

PubChemData

Smile

CC(=C)C(C1C[C@@H]2C=C[C@H]1OO2)OO

DOS

IR

Vibrations