Geometry & MOs

Info

ID:	293897
PubChem CID:	117410698
Reduced:	O3C16H22 (1)
Stoich.:	A3B16C22 (1)
Weight, g/mol:	262.156895
ΔH_f, kcal/mol:	-141.6
Dipole, Da:	5.39
IP(EA), eV:	-9.82(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(4,4-dimethylcyclohexyl)phenyl]-2-hydroxyacetic acid

Drug info:

PubChemData

Smile

CC1(CCCC(C1)C2=CC=CC=C2C(C(=O)O)O)C

DOS

IR

Vibrations