Geometry & MOs

Info

ID:	303880
PubChem CID:	124490580
Reduced:	O3C10H18 (1)
Stoich.:	A3B10C18 (1)
Weight, g/mol:	198.125594
ΔH_f, kcal/mol:	-165.29
Dipole, Da:	4.91
IP(EA), eV:	-10.49(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2S)-2-[(1R)-2,2-dimethyl-3-methylidenecyclopentyl]-2-hydroxyacetate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations