Geometry & MOs

Info

ID:	399898
PubChem CID:	135043606
Reduced:	O2Rh2C11H18 (1)
Stoich.:	A2B2C11D18 (1)
Weight, g/mol:	208.109944
ΔH_f, kcal/mol:	-142.35
Dipole, Da:	1.07
IP(EA), eV:	-9.08(-4.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-hydroxy-3,5-dimethylphenyl)methyl propanoate

Drug info:

PubChemData

Smile

C1C2CC3CC1CC(C2)(C3)C(O)O.[Rh].[Rh]

DOS

IR

Vibrations