Geometry & MOs

Info

ID:	263550
PubChem CID:	103377732
Reduced:	O2C5H9 (2)
Stoich.:	A2B5C9 (2)
Weight, g/mol:	292.167459
ΔH_f, kcal/mol:	-189.33
Dipole, Da:	7.07
IP(EA), eV:	-10.37(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-hydroxybutan-2-yloxy)-4-phenylcyclohexane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC(C(C)OC(C1CCC1)C(=O)O)O

DOS

IR

Vibrations