Accuracy

tri-n-butyltin bromide   5590 Tri-n-butyltin bromide

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    #  Species Formula
  5580 Sn(IV)Cl6(2-) (AMCLSN10) (Geo)Cl6Sn
  5581 Sn(IV)Cl6(2-) (AMCLSN10)Cl6Sn
  5582 GeH3-SnH3 (Geo)H6GeSn
  5583 GeMe3-SnMe3C6H18GeSn
  5584 Tin selenide (Geo)SeSn
  5585 Tin selenideSeSn
  5586 Tin bromideBrSn
  5587 Tin bromide trihydride (Geo)H3BrSn
  5588 Trimethyltin bromide (Geo)C3H9BrSn
  5589 Trimethyltin bromideC3H9BrSn
  5590 Tri-n-butyltin bromide C12H27BrSn
  5591 Tin dibromide (Geo)Br2Sn
  5592 Tin dibromideBr2Sn
  5593 Dimethyltin dibromide (Geo)C2H6Br2Sn
  5594 Dimethyltin dibromideC2H6Br2Sn
  5595 Sn(IV)S4Br2 (CARSNA) (Geo)C6H10O2S4Br2Sn
  5596 Sn(IV)S4Br2 (CARSNA)C6H10O2S4Br2Sn
  5597 Sn(II)Br3(-) (BITYAE) (Geo)Br3Sn
  5598 Sn(II)Br3(-) (BITYAE)Br3Sn
  5599 Tin tetrabromide (Geo)Br4Sn
  5600 Tin tetrabromideBr4Sn


ΔHf: -65.7 kcal/mol,     REF: J. O. Cox, G. Pilcher, "Thermochemistry of Organic and Organometallic Compounds," Academic Press, New York, N.Y., 1970.
  
 PM7
Tri-n-butyltin bromide
 H=-65.7,4.0 HR=C&P1970
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.52955226 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Sn     2.14815671 +1  116.3842141 +1    0.0000000 +0     2     1     0
  C     2.14994524 +1  112.1722978 +1  -43.9318773 +1     3     2     1
  C     1.52968411 +1  115.9153243 +1  -57.9715364 +1     4     3     2
  C     1.54073014 +1  110.3090742 +1  178.7541540 +1     5     4     3
  H     1.10742338 +1  111.1720350 +1   57.9621006 +1     5     4     3
  H     1.10660815 +1  111.2533994 +1  -60.2226970 +1     5     4     3
  H     1.10240654 +1  108.4958245 +1  178.4393709 +1     4     3     2
  H     1.10349314 +1  107.8398461 +1   64.8970234 +1     4     3     2
  C     2.14808785 +1  111.5890246 +1 -169.4737187 +1     3     2     1
  H     1.10293149 +1  109.2956494 +1  123.1051876 +1     2     1     3
  H     1.10303497 +1  109.4783441 +1 -121.9228791 +1     2     1     3
  C     1.54059036 +1  110.3064193 +1  178.0190667 +1     1     2     3
  H     1.10693852 +1  111.2927189 +1   56.9958245 +1     1     2     3
  H     1.10724701 +1  111.1311398 +1  -61.0743846 +1     1     2     3
  C     1.52934510 +1  116.6959624 +1  -44.8695306 +1    11     3     2
  H     1.10329073 +1  108.1054447 +1 -168.3972297 +1    11     3     2
  H     1.10321732 +1  107.3446232 +1   78.4050646 +1    11     3     2
  C     1.54061091 +1  110.3414924 +1  178.3057101 +1    17    11     3
  H     1.10657686 +1  111.3461789 +1   57.1933702 +1    17    11     3
  H     1.10756289 +1  111.0593204 +1  -60.9088355 +1    17    11     3
  C     1.52868637 +1  111.0042083 +1  179.8142919 +1     6     5     4
  H     1.10542382 +1  109.9575014 +1   57.8437624 +1     6     5     4
  H     1.10569223 +1  109.9087861 +1  -58.2669209 +1     6     5     4
  C     1.52861984 +1  110.9919735 +1  179.9697593 +1    14     1     2
  H     1.10554482 +1  109.8881157 +1   58.0672199 +1    14     1     2
  H     1.10525887 +1  109.9382090 +1  -58.0764659 +1    14     1     2
  C     1.52867380 +1  110.9992466 +1  179.9383512 +1    20    17    11
  H     1.10567647 +1  109.8854833 +1   58.0741261 +1    20    17    11
  H     1.10524343 +1  109.9789749 +1  -58.0621725 +1    20    17    11
  H     1.09550955 +1  111.2926626 +1  179.7045213 +1    23     6     5
  H     1.09553896 +1  111.4501282 +1   59.7904618 +1    23     6     5
  H     1.09535543 +1  111.4764700 +1  -60.3774212 +1    23     6     5
  H     1.09532800 +1  111.2986023 +1 -179.6698594 +1    26    14     1
  H     1.09546255 +1  111.4583403 +1   60.3504263 +1    26    14     1
  H     1.09580583 +1  111.4282397 +1  -59.7698669 +1    26    14     1
  H     1.09542366 +1  111.2935791 +1 -179.7520227 +1    29    20    17
  H     1.09534024 +1  111.4819581 +1   60.2642700 +1    29    20    17
  H     1.09585578 +1  111.4118174 +1  -59.8574424 +1    29    20    17
 Br     2.42035207 +1  107.5289380 +1   72.6310736 +1     3     2     1