Geometry & MOs

Info

ID:	265805
PubChem CID:	103547747
Reduced:	NO4C11H13 (1)
Stoich.:	AB4C11D13 (1)
Weight, g/mol:	214.156895
ΔH_f, kcal/mol:	-157.94
Dipole, Da:	1.37
IP(EA), eV:	-9.62(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(2-ethylcyclohexyl)oxybutanoic acid

Drug info:

PubChemData

Smile

C[C@@H](CC(=O)O)OC1=CC=CC=C1C(=O)N

DOS

IR

Vibrations