KEGG   COMPOUND: C18149Help
Entry
C18149                      Compound                               

Name
Tributyltin oxide;
TBTO
Formula
C24H54OSn2
Exact mass
598.2219
Mol weight
596.105
Structure
Mol fileKCF fileDB search
Brite
Pesticides [BR:br08007]
 Obsolete pesticides
  Fungicides
   Others
    C18149  Tributyltin oxide
BRITE hierarchy
Other DBs
CAS: 56-35-9
PubChem: 96024366
ChEBI: 81543
NIKKAJI: J4.568C
LinkDB All DBs
KCF data Show

ATOM        27
            1   O2a O    22.2600  -26.1100
            2   Z   Sn   23.3800  -26.1100
            3   Z   Sn   20.5800  -26.1100
            4   C1b C    19.8800  -24.8976
            5   C1b C    19.8800  -27.3224
            6   C1b C    19.1800  -26.1100
            7   C1b C    20.5704  -23.7021
            8   C1b C    19.8848  -22.5148
            9   C1a C    20.5728  -21.3234
            10  C1b C    18.4800  -24.8976
            11  C1b C    17.0802  -24.8976
            12  C1a C    16.3897  -23.7020
            13  C1b C    18.4802  -27.3224
            14  C1b C    17.7897  -28.5180
            15  C1a C    16.3803  -28.5180
            16  C1b C    24.0800  -27.3224
            17  C1b C    24.0800  -24.8976
            18  C1b C    24.7800  -26.1100
            19  C1b C    23.3896  -28.5179
            20  C1b C    24.0752  -29.7052
            21  C1a C    23.3872  -30.8966
            22  C1b C    25.4800  -27.3224
            23  C1b C    26.8798  -27.3224
            24  C1a C    27.5703  -28.5180
            25  C1b C    25.4798  -24.8976
            26  C1b C    26.1703  -23.7020
            27  C1a C    27.5797  -23.7020
BOND        26
            1     1   2 1
            2     1   3 1
            3     3   4 1
            4     3   5 1
            5     3   6 1
            6     4   7 1
            7     7   8 1
            8     8   9 1
            9     6  10 1
            10   10  11 1
            11   11  12 1
            12    5  13 1
            13   13  14 1
            14   14  15 1
            15    2  16 1
            16    2  17 1
            17    2  18 1
            18   16  19 1
            19   19  20 1
            20   20  21 1
            21   18  22 1
            22   22  23 1
            23   23  24 1
            24   17  25 1
            25   25  26 1
            26   26  27 1

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