Accuracy

cis-pt(pet3)2cl(ch3)   7712 cis-Pt(PEt3)2Cl(CH3)

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    #  Species Formula
  7702 Platinum(cyclooctadiene) maleonitriledithiolato (Geo)C12H12N2S2Pt
  7703 Platinum(cyclooctadiene) maleonitriledithiolatoC12H12N2S2Pt
  7704 Pt(Cyclo-octadiene) maleonitriledithiolato (Geo)C12H12N2S2Pt
  7705 cis-Pt(PEt3)2(SEt)2C16H40P2S2Pt
  7706 Pt(III)S4(-) (BEKSIT) (Geo)C8N4S4Pt
  7707 Pt(III)S4(-) (BEKSIT)C8N4S4Pt
  7708 Methyl platinum(II) chlorideCH3ClPt
  7709 Methyl platinum(II) chloride (Geo)CH3ClPt
  7710 Pt(II)N2ClO (ACHGLP10) (Geo)C2H7N2O2ClPt
  7711 Pt(II)N2ClO (ACHGLP10)C2H7N2O2ClPt
  7712 cis-Pt(PEt3)2Cl(CH3) C13H33P2ClPt
  7713 cis-Pt(PEt3)2Cl(2-Tol)C19H37P2ClPt
  7714 Pt(II)C4Cl2 (BOFTEV) (Geo)C4H8Cl2Pt
  7715 Pt(II)C4Cl2 (BOFTEV)C4H8Cl2Pt
  7716 Pt(cyclooctadiene)Cl2C8H12Cl2Pt
  7717 Pt(II)Cl2NC2 (ETDMAX) (Geo)C4H9NCl2Pt
  7718 Pt(II)Cl2NC2 (ETDMAX)C4H9NCl2Pt
  7719 Cis-Pt(NH3)2Cl2H6N2Cl2Pt
  7720 Pt(II)N2Cl2 (CUKRAB) (Geo)H6N2Cl2Pt
  7721 Pt(II)N2Cl2 (CUKRAB)H6N2Cl2Pt
  7722 Cis-Pt(NH2C2H4NH2)2Cl2C2H8N2Cl2Pt


ΔHf: -99.6 kcal/mol,     REF: D. Takhin and H. A. Skinner, J. Chem. Soc., Dalton Trans., 371 (1984).
  
 PM7
cis-Pt(PEt3)2Cl(CH3)
 H=-99.6 HR=TS1984
 Pt     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     2.04797502 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Cl     2.30867496 +1   87.4485655 +1    0.0000000 +0     1     2     0
  P     2.30346389 +1   98.0967764 +1 -178.1660193 +1     1     2     3
  P     3.95397384 +1   90.5172885 +1  136.0565110 +1     1     3     2
  C     1.86783068 +1  113.9721464 +1 -161.9209456 +1     4     1     2
  C     1.87007704 +1  115.6916993 +1   79.9062451 +1     4     1     2
  C     1.88317822 +1  112.8688396 +1  -41.7816420 +1     4     1     2
  C     1.92233391 +1   88.2294013 +1  -69.8472373 +1     5     1     3
  C     1.91661616 +1  166.5449757 +1  112.2121591 +1     5     1     3
  C     1.92122674 +1   69.8264986 +1   36.3886998 +1     5     1     3
  C     1.54270368 +1  116.6655542 +1   56.9379829 +1     6     4     1
  H     1.12421670 +1  110.0169714 +1 -179.1747488 +1     6     4     1
  H     1.13067349 +1  108.9479854 +1  -65.1470931 +1     6     4     1
  H     1.13015056 +1  108.6930616 +1   76.7006178 +1     7     4     1
  C     1.54234312 +1  116.9742829 +1  -45.0358523 +1     7     4     1
  H     1.12342955 +1  109.9271652 +1 -169.3833417 +1     7     4     1
  C     1.53983918 +1  118.5113737 +1 -176.3874221 +1     8     4     1
  H     1.12638741 +1  108.6080208 +1   60.1822213 +1     8     4     1
  H     1.12896820 +1  108.0175764 +1  -53.4428825 +1     8     4     1
  H     1.12002724 +1  110.8967135 +1  138.8767433 +1     9     5     1
  H     1.12388627 +1  107.5632500 +1 -105.9444085 +1     9     5     1
  C     1.53954556 +1  114.8174897 +1   15.3735292 +1     9     5     1
  H     1.12593951 +1  107.6459250 +1  107.9132629 +1    10     5     1
  C     1.53739171 +1  119.3562729 +1 -128.0510927 +1    10     5     1
  H     1.12772804 +1  107.1460853 +1   -4.6478528 +1    10     5     1
  C     1.53948875 +1  115.4509194 +1   60.9536386 +1    11     5     1
  H     1.11822604 +1  110.8112168 +1 -174.2388212 +1    11     5     1
  H     1.13329032 +1  108.2227463 +1  -59.1998716 +1    11     5     1
  H     1.10071999 +1  109.4273601 +1  179.1516028 +1    25    10     5
  H     1.09887615 +1  113.4391678 +1   60.6936356 +1    25    10     5
  H     1.09807893 +1  113.4679628 +1  -62.2792851 +1    25    10     5
  H     1.09535784 +1  110.0156921 +1 -156.4099141 +1    23     9     5
  H     1.10068070 +1  112.5648419 +1   84.3464940 +1    23     9     5
  H     1.11870560 +1  114.6381561 +1  -35.8129040 +1    23     9     5
  H     1.10207242 +1  108.8167581 +1  177.8311154 +1    27    11     5
  H     1.09508848 +1  114.3892605 +1   58.1064765 +1    27    11     5
  H     1.10863427 +1  112.5824762 +1  -65.8909671 +1    27    11     5
  H     1.10037155 +1  109.3869324 +1  179.3343416 +1    18     8     4
  H     1.09852462 +1  113.5183355 +1   61.0558720 +1    18     8     4
  H     1.09799206 +1  113.6060109 +1  -62.3072690 +1    18     8     4
  H     1.09774639 +1  113.5587224 +1   65.3578457 +1    12     6     4
  H     1.10271843 +1  113.4613108 +1  -57.6720558 +1    12     6     4
  H     1.09969567 +1  109.2767663 +1 -175.9833333 +1    12     6     4
  H     1.09959643 +1  109.2101779 +1  177.4313860 +1    16     7     4
  H     1.10379520 +1  112.8821886 +1   59.7801366 +1    16     7     4
  H     1.09685086 +1  113.7737144 +1  -63.8748822 +1    16     7     4
  H     1.09398448 +1  107.1551290 +1    0.3120645 +1     2     1     3
  H     1.08724841 +1  110.1222405 +1  118.5362381 +1     2     1     3
  H     1.08675270 +1  109.8877068 +1 -117.6364353 +1     2     1     3