Geometry & MOs

Info

ID:	294706
PubChem CID:	117484271
Reduced:	OC10H14 (2)
Stoich.:	AB10C14 (2)
Weight, g/mol:	300.20893
ΔH_f, kcal/mol:	-107.95
Dipole, Da:	5.59
IP(EA), eV:	-9.56(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-cycloheptylphenyl)cyclohexane-1-carboxylic acid

Drug info:

PubChemData

Smile

C1CCCC(CC1)C2=CC(=CC=C2)C3(CCCCC3)C(=O)O

DOS

IR

Vibrations