KEGG   COMPOUND: C11744Help
Entry
C11744                      Compound                               

Name
Salvarsan;
Arsphenamine
Formula
C12H12As2N2O2. 2HCl
Exact mass
437.8864
Mol weight
439.001
Structure
Mol fileKCF fileDB search
Other DBs
CAS: 139-93-5
PubChem: 13909
ChEBI: 9016
NIKKAJI: J518.677C
LinkDB All DBs
KCF data Show

ATOM        20
            1   X   Cl    7.2875   -1.5500
            2   X   Cl   -1.9750   -1.5500
            3   C8x C     0.2833   -2.3042
            4   C8x C     1.1083   -2.3042
            5   C8y C     1.5208   -1.5897
            6   C8x C     1.1083   -0.8752
            7   C8y C     0.2833   -0.8752
            8   C8y C    -0.1292   -1.5897
            9   N1a N    -0.1292   -0.1608
            10  O1a O    -0.9542   -1.5897
            11  Z   As    2.3458   -1.5897
            12  Z   As    3.1708   -1.5875
            13  C8y C     3.9958   -1.5875
            14  C8x C     4.4083   -2.3020
            15  C8x C     5.2333   -2.3020
            16  C8y C     5.6458   -1.5875
            17  C8y C     5.2333   -0.8730
            18  C8x C     4.4083   -0.8730
            19  N1a N     5.6458   -0.1586
            20  O1a O     6.4708   -1.5875
BOND        19
            1     8  10 1
            2     5  11 1
            3     3   4 2
            4    11  12 2
            5     4   5 1
            6    12  13 1
            7     5   6 2
            8     6   7 1
            9     7   8 2
            10    8   3 1
            11   13  14 2
            12   14  15 1
            13   15  16 2
            14   16  17 1
            15   17  18 2
            16   18  13 1
            17    7   9 1
            18   17  19 1
            19   16  20 1

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