F5T
- Molecular formula
- C6 H11 F3 O8 Rh2
- Molecular weight (g/mol)
- 473.95
- Classification
- LIKELY_SYNTHETIC
Related PDB structures · 1
Names & identifiers
- IUPAC name
- cis-bis(mi2-acetato-O, O')-(mi2-trifluoroacetato-O, O')-diaquo-dirhodium (II)
- SMILES
- CC1O[Rh+]23(OC(O[Rh+]2(O1)(OC(O3)C(F)(F)F)O)C)O
- Isomeric SMILES
- CC1O[Rh+]23(OC(O[Rh+]2(O1)(OC(O3)C(F)(F)F)O)C)O
- InChI
- InChI=1S/C2HF3O2.2C2H4O2.2H2O.2Rh/c3-2(4,5)1(6)7;2*1-2(3)4;;;;/h1H;2*2H,1H3;2*1H2;;/q3*-2;;;2*+5/p-2
- InChIKey
- AAVQFBAKNWVTEL-UHFFFAOYSA-L
Chemical & physical properties
- HBA
- 8
- HBD
- 2
- TPSA (Ų)
- 95.84
- cLogP
- 0.31
- Chiral atoms
- 0
- Molar refractivity
- 39.71
- Rings
- 3
- Aromatic rings
- 0
- Fraction Csp³
- 1.0
- Formal charge
- 2
Calculated properties
QED0.485
NPScore-0.124966268
SAScore7.754472826