KEGG   COMPOUND: C15435
Entry
C15435                      Compound                               
Name
Fenbutatin oxide;
Bis[tris(2-methyl-2-phenylpropyl)tin]oxide
Formula
C60H78OSn2
Exact mass
1054.4097
Mol weight
1052.6807
Structure
Brite
Pesticides [BR:br08007]
 Pesticides
  Insecticides
   Acaricides
    C15435  Fenbutatin oxide
Other DBs
CAS: 13356-08-6
PubChem: 17396432
ChEBI: 39294
NIKKAJI: J962H
KCF data

ATOM        63
            1   Z   Sn   25.4800  -16.6600
            2   C1b C    25.4800  -15.2600
            3   C1b C    25.4800  -18.0600
            4   C1b C    24.0800  -16.6600
            5   O2a O    27.5800  -16.6600
            6   C1d C    26.6924  -14.5600
            7   C1d C    24.2676  -18.7600
            8   C1d C    23.3800  -15.4476
            9   C1a C    27.6779  -15.3204
            10  C8y C    26.6925  -13.1602
            11  C8x C    27.8881  -12.4698
            12  C8x C    27.8880  -11.0698
            13  C8x C    26.6755  -10.3699
            14  C8x C    25.4799  -11.0603
            15  C8x C    25.4800  -12.4603
            16  C8y C    21.9802  -15.4476
            17  C8x C    21.2897  -14.2520
            18  C8x C    19.8897  -14.2522
            19  C8x C    19.1899  -15.4647
            20  C8x C    19.8803  -16.6602
            21  C8x C    21.2803  -16.6601
            22  C1a C    23.0721  -18.0696
            23  C8y C    24.2675  -20.1598
            24  C8x C    23.0719  -20.8502
            25  C8x C    23.0720  -22.2502
            26  C8x C    24.2845  -22.9501
            27  C8x C    25.4801  -22.2597
            28  C8x C    25.4800  -20.8597
            29  C1a C    27.9049  -13.8600
            30  C1a C    23.0551  -19.4600
            31  C1a C    23.3677  -14.0953
            32  C1a C    24.5099  -14.2476
            33  Z   Sn   29.4000  -16.6600
            34  C1b C    29.4000  -18.0600
            35  C1b C    30.8000  -16.6600
            36  C1b C    29.4000  -15.2600
            37  C1d C    30.6124  -14.5600
            38  C1d C    31.5000  -17.8724
            39  C1d C    28.1876  -18.7600
            40  C1a C    27.3421  -18.0696
            41  C8y C    28.1875  -20.1598
            42  C8x C    26.9919  -20.8502
            43  C8x C    26.9920  -22.2502
            44  C8x C    28.2045  -22.9501
            45  C8x C    29.4001  -22.2597
            46  C8x C    29.4000  -20.8597
            47  C8y C    32.8998  -17.8724
            48  C8x C    33.5903  -19.0680
            49  C8x C    34.9903  -19.0678
            50  C8x C    35.6901  -17.8553
            51  C8x C    34.9997  -16.6598
            52  C8x C    33.5997  -16.6599
            53  C1a C    31.8079  -15.6004
            54  C8y C    30.6125  -13.1602
            55  C8x C    31.8081  -12.4698
            56  C8x C    31.8080  -11.0698
            57  C8x C    30.5955  -10.3699
            58  C8x C    29.3999  -11.0603
            59  C8x C    29.4000  -12.4603
            60  C1a C    31.8249  -13.8600
            61  C1a C    30.8000  -19.0849
            62  C1a C    32.0600  -19.2249
            63  C1a C    26.9751  -19.4600
BOND        68
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1
            5     2   6 1
            6     3   7 1
            7     4   8 1
            8     6   9 1
            9     6  10 1
            10   10  11 2
            11   11  12 1
            12   12  13 2
            13   13  14 1
            14   14  15 2
            15   10  15 1
            16    8  16 1
            17   16  17 2
            18   17  18 1
            19   18  19 2
            20   19  20 1
            21   20  21 2
            22   16  21 1
            23    7  22 1
            24    7  23 1
            25   23  24 2
            26   24  25 1
            27   25  26 2
            28   26  27 1
            29   27  28 2
            30   23  28 1
            31    6  29 1
            32    7  30 1
            33    8  31 1
            34    8  32 1
            35    5  33 1
            36   33  34 1
            37   33  35 1
            38   33  36 1
            39   36  37 1
            40   35  38 1
            41   34  39 1
            42   39  40 1
            43   39  41 1
            44   41  42 2
            45   42  43 1
            46   43  44 2
            47   44  45 1
            48   45  46 2
            49   41  46 1
            50   38  47 1
            51   47  48 2
            52   48  49 1
            53   49  50 2
            54   50  51 1
            55   51  52 2
            56   47  52 1
            57   37  53 1
            58   37  54 1
            59   54  55 2
            60   55  56 1
            61   56  57 2
            62   57  58 1
            63   58  59 2
            64   54  59 1
            65   37  60 1
            66   38  61 1
            67   38  62 1
            68   39  63 1

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