Geometry & MOs

Info

ID:	256908
PubChem CID:	103142327
Reduced:	O3C14H24 (1)
Stoich.:	A3B14C24 (1)
Weight, g/mol:	268.203845
ΔH_f, kcal/mol:	-174.98
Dipole, Da:	4.18
IP(EA), eV:	-9.76(0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5-methyloxolan-2-yl)methyl]-4-propan-2-ylcyclohexane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC1CCC(O1)CC2(CCCCCC2)C(=O)O

DOS

IR

Vibrations