Geometry & MOs

Info

ID:	12983
PubChem CID:	219463
Reduced:	O2C5H8 (2)
Stoich.:	A2B5C8 (2)
Weight, g/mol:	200.104859
ΔH_f, kcal/mol:	-202.95
Dipole, Da:	3.61
IP(EA), eV:	-10.95(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,3R)-1,2,2-trimethylcyclopentane-1,3-dicarboxylic acid

Drug info:

PubChemData

Smile

C[C@@]1(CC[C@H](C1(C)C)C(=O)O)C(=O)O

DOS

IR

Vibrations