Chemistry Reference
In-Depth Information
pTO
2
= 0.07 (±0.01)
E
HOMO(g)
+ 0.18 (±0.06)
E
LUMO
C
max
+ 3.64 (±0.29)
0.95
0.17
47.46
8
pTO
2
= 0.08 (±0.01)
E
HOMO(g)
+ 0.13 (±0.04)
E
LUMO
C
min
+ 4.03 (±0.32)
0.95
0.18
44.69
8
X
2
pTO
2
= 0.10 (±0.03) log K
OH
+ 0.57 (±0.09)
r
0.92
0.22
27.82
8
- 1.33 (±0.34)
pTO
2
= 0.12 (±0.05)
E
HOMO(aq)
+ 0.34 (±0.10)
E
LUMO
C
max
+ 3.21 (±0.59)
0.78
0.36
9.08
8
pTCO
2
= 0.14 (±0.05)
E
HOMO(aq)
+ 0.31 (±0.12)
E
LUMO
C
max
+ 3.14 (±0.67)
0.74
0.41
7.13
8
Mendes et al. (2010)
Ag
1+
, Ba
2+
, Ca
2+
, Cd
2+
, Co
2+
, Cs
1+
,
Cu
2+
, Fe
2+
, Hg
2+
, K
1+
, Li
1+
, Mg
2+
,
Mn
2+
, Na
1+
, Ni
2+
, Pb
2+
, Sr
2+
, Zn
2+
Log EC
50
= 3.57 − 0.07(AN)
Log EC
50
= −1.91 +2.65(AR)
Log EC
50
= 4.93 - 0.37(ΔIP)
0.708
0.462
0.639
0.0007
0.0128
0.0019
−47.32
−40.59
−44.97
18
18
18
Log EC
50
= −3.10 + 0.46(log |
K
OH
|)
0.757
0.003
−49.33
18
B
Log EC
50
= 0.21 + 2.15r
0.011
0.3187
−33.9
18
Log EC
50
= 3.05 − 0.40(AN/ΔIP)
0.219
0.0828
−36.5
18
Log EC
50
= 4.24 - 1.27
X
r
(
2
)
0.911
0.0001
−60.42
18
A
Log EC
50
= 3.52 − 0.38(Z
2
/r)
0.405
0.0209
−39.49
18
E
2
Log EC
50
= 3.69 −1.18
X
r
(
)
+ 0.04(log|
K
OH
|)
0.901
0.0001
−55.31
18
D
m
Log of the equilibrium constant (log K
eq
) of the metal-ATP complex
Covalent index
X
r
m
( )
Log of the first hydrolysis constant (|log
K
OH
|)
Ionic index (Z
2
/r)
Log of the stability constant for the metal fluoride; log of the stability constant for the metal chloride (Δβ)
Log metal hydroxide solubility, (Log-K
so
MOH)
Ionization potential (IP)
(
Continued
)
