4,4-Difluoro-1,3,5,7-tetramethyl-4-bora-3a,4a-diaza-s-indacene
C13H15BF2N2
21658-70-8 Copyright (C) 2025 ACS
 18 20  0  0  0  0  0  0  0  0999 V2000
    8.3817    3.2742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9737    5.8448    0.0000 F   0  5  0  0  0  1  0  0  0  0  0  0
    3.6882    6.8348    0.0000 F   0  5  0  0  0  1  0  0  0  0  0  0
    5.6711    7.9690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7106    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.6948    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7309    3.9845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9609    5.3182    0.0000 N   0  5  0  0  0  3  0  0  0  0  0  0
    4.9609    2.6508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2372    4.3047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4209    5.3182    0.0000 B   0  1  0  0  0  4  0  0  0  0  0  0
    5.9913    6.4627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4209    2.6508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3983    5.8362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6508    3.9845    0.0000 N   0  0  0  0  0  4  0  0  0  0  0  0
    2.3904    1.5063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1445    3.6643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9835    2.1328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 10  1  0  0  0  0
  2 11  1  0  0  0  0
  3 11  1  0  0  0  0
  4 12  1  0  0  0  0
  5 16  1  0  0  0  0
  6 17  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 10  2  0  0  0  0
  8 11  1  0  0  0  0
  8 12  1  0  0  0  0
  9 13  2  0  0  0  0
 10 14  1  0  0  0  0
 11 15  1  0  0  0  0
 12 14  2  0  0  0  0
 13 15  1  0  0  0  0
 13 16  1  0  0  0  0
 15 17  2  0  0  0  0
 16 18  2  0  0  0  0
 17 18  1  0  0  0  0
M  CHG  4   2  -1   3  -1   8  -1  11   3
M  END
> <cas.rn>
21658-70-8

> <ca.index.name>
Boron, [2-[(3,5-dimethyl-2H-pyrrol-2-ylidene-κN)methyl]-3,5-dimethyl-1H-pyrrolato-κN]difluoro-, (T-4)-

> <molecular.formula>
C13H15BF2N2

> <smiles.canonical>
[F-][B+3]1([F-])[N]=2C(=CC3=C(C=C([N-]31)C)C)C(=CC2C)C

> <molecular.weight>
248.08

> <melting.point.experimental>
214 °C

$$$$
