Chemo-Informatics: Contradictions DB: Critical Pressure
Critical Pressure [Bar]
Maybe the source of Database-A and Database-C is same. Almost all data is same. But Database-A and Database-C, they put estimated value without notification for the compounds that do not have value. For Critical Pressure case I want to expect the error within 0.5bar, so I put several compounds that does not meet the error range.
Structure |
DB-A |
DB-B |
DB-C |
DB-D |
DB-E |
DB-F |
DB-G |
|
63.13 |
63.12 |
63.13 |
63.12 |
58.7 |
63.1 |
63.1 |
|
74.57 |
74.57 |
74.57 |
74.58 |
76.14 |
74.60 |
74.6 |
|
55.5 |
55.73 |
55.50 |
64.03 |
55.70 |
55.7 |
|
|
55.3 |
55.32 |
55.30 |
56.88 |
55.3 |
55.3 |
55.3 |
|
63.84 |
61.40 |
63.84 |
63.79 |
61.37 |
61.40 |
63.8 |
|
75.3 |
77.00 |
75.30 |
77.00 |
|||
|
68.7 |
44.58 |
68.70 |
44.68 |
44.50 |
||
|
62.9 |
62.82 |
62.90 |
62.92 |
67.07 |
62.8 |
|
|
50.0 |
51.67 |
50.0 |
51.70 |
|||
|
50.20 |
57.70 |
|||||
|
41.85 |
41.84 |
41.85 |
41.84 |
42.6 |
41.80 |
|
|
46.6 |
63.29 |
46.60 |
52.7 |
47.60 |
||
|
46.7 |
47.62 |
46.7 |
47.60 |
|||
|
45.3 |
53.99 |
45.30 |
53.7 |
45.3 |
53.7 |
53.7 |
|
44.2 |
44.2 |
52.17 |
||||
|
39.52 |
39.49 |
39.52 |
44.75 |
39.50 |
43 |
|
|
59.2 |
89.50 |
59.2 |
89.50 |
59.80 |
||
|
50.1 |
50.10 |
52.85 |
||||
|
40.0 |
66.80 |
40.00 |
66.90 |
|||
|
47.42 |
48.10 |
47.42 |
47.38 |
47.2 |
47.40 |
47.4 |
|
63.0 |
72.80 |
|||||
|
38.8 |
39.51 |
38.8 |
39.5 |
|||
|
62.1 |
56.74 |
62.10 |
56.74 |
63.4 |
65.00 |
|
|
42.5 |
43.57 |
42.5 |
22.70 |
43.50 |
||
|
59.40 |
34.45 |
51.31 |
||||
|
46.81 |
46.81 |
46.81 |
46.81 |
40.0 |
46.79 |
46.8 |
|
37.9 |
37.89 |
37.90 |
37.89 |
38.8 |
37.89 |
37.9 |
|
40.0 |
53.8 |
40.00 |
43.2 |
40.5 |
||
|
41.0 |
41.54 |
41.0 |
41.54 |
|||
|
41.54 |
42.10 |
41.54 |
41.54 |
42.07 |
41.50 |
41.5 |
|
44.2 |
52.69 |
44.20 |
52.69 |
40.3 |
52.70 |
52.7 |
|
38.8 |
38.3 |
38.8 |
38.2 |
38.82 |
38.2 |
|
|
40.53 |
40.53 |
40.53 |
40.53 |
37.0 |
40.50 |
40.50 |
|
56.13 |
56.13 |
56.13 |
60.0 |
56.1 |
56.1 |
|
|
53.4 |
54.71 |
53.4 |
54.71 |
54.70 |
