KEGG   COMPOUND: C15449
Entry
C15449                      Compound                               
Name
trans-1,2-Diphenylcyclobutane
Formula
C16H16
Exact mass
208.1252
Mol weight
208.2982
Structure
Other DBs
PubChem: 17396446
ChEBI: 79947
NIKKAJI: J259.518D
KCF data

ATOM        16
            1   C1x C    28.1052  -18.1644
            2   C1y C    28.1052  -19.5616
            3   C1y C    29.5025  -19.5616
            4   C1x C    29.5025  -18.1644
            5   C8x C    24.4723  -20.2603
            6   C8x C    24.4723  -21.6575
            7   C8x C    25.6600  -22.3562
            8   C8x C    26.9175  -21.6575
            9   C8y C    26.9175  -20.2603
            10  C8x C    25.6600  -19.5616
            11  C8x C    33.1354  -20.2603
            12  C8x C    33.1354  -21.6575
            13  C8x C    31.9477  -22.3562
            14  C8x C    30.6901  -21.6575
            15  C8y C    30.6901  -20.2603
            16  C8x C    31.9477  -19.5616
BOND        18
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     1   4 1
            5     5   6 2
            6     6   7 1
            7     7   8 2
            8     8   9 1
            9     9  10 2
            10    5  10 1
            11    2   9 1 #Down
            12   11  12 2
            13   12  13 1
            14   13  14 2
            15   14  15 1
            16   15  16 2
            17   11  16 1
            18    3  15 1 #Up

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