Accuracy

cis-pt(1,2-cbda)(nh2me)2   7681 Cis-Pt(1,2-cbda)(NH2Me)2

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    #  Species Formula
  7671 Pt(CO)4 (Geo)C4O4Pt
  7672 Pt(NH3)2(malonate) (Geo)C3H8N2O4Pt
  7673 Pt(II)N2O2 (CAGDUJ) (Geo)C5H6N2O4Pt
  7674 Pt(II)N2O2 (CAGDUJ)C5H6N2O4Pt
  7675 Pt(CH2(COO)2)(NH2C2H4NH2)C5H10N2O4Pt
  7676 Pt((COO)2CHEt)(NH3)2C5H12N2O4Pt
  7677 Cis-Pt(1,1-cbda)(NH3)2C6H12N2O4Pt
  7678 Pt(IV)N2O2C2 (BAVHIP) (Geo)C6H14N2O4Pt
  7679 Pt(IV)N2O2C2 (BAVHIP)C6H14N2O4Pt
  7680 Cis-Pt(1,1-cbda)(NH2Me)2 (34)C8H16N2O4Pt
  7681 Cis-Pt(1,2-cbda)(NH2Me)2 C8H16N2O4Pt
  7682 Cis-Pt(1,1-cbda)(NH2Et)2C10H20N2O4Pt
  7683 Cis-Pt(1,1-cbda)(NH2-i-Pr)2C12H24N2O4Pt
  7684 Pt((COO)2CH(OH))(NH3)2C3H8N2O5Pt
  7685 Pt(II)(H2O)6H12O6Pt
  7686 Pt(II)(H2O)6 (Geo)H12O6Pt
  7687 Pt(IV)O4N2 (BIPWIG) (Geo)C3H10N2O6Pt
  7688 Pt(IV)O4N2 (BIPWIG)C3H10N2O6Pt
  7689 Platinum EDTA (Geo)C10H12N2O8Pt
  7690 Platinum EDTAC10H12N2O8Pt
  7691 Methyl platinum(II) fluorideCH3FPt


ΔHf: -129.9 kcal/mol,     REF: D. Takhin, G. Pilcher, J. Bickerton, and A. Zaki, J. Chem. Soc., Dalton Trans., 371 (1984).
  
 SHIFT=10 PM7
Cis-Pt(1,2-cbda)(NH2Me)2
 H=-129.9 HR=TPBZ84
 Pt     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     2.03591389 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.03836439 +1  105.1443987 +1    0.0000000 +0     1     2     0
  N     2.03835067 +1   73.7651327 +1  176.4970175 +1     1     2     3
  N     2.03730937 +1  178.8868153 +1   -3.8226240 +1     1     2     3
  C     1.49748924 +1  114.6569567 +1   84.6277781 +1     4     1     2
  H     1.04155059 +1  104.6878961 +1  -34.4357912 +1     4     1     2
  H     1.01579258 +1  112.0110783 +1 -149.4396615 +1     4     1     2
  C     1.49912636 +1  112.8105337 +1  104.2648348 +1     5     1     3
  H     1.04030311 +1  106.8154030 +1  -14.0191994 +1     5     1     3
  H     1.01573373 +1  112.5876695 +1 -130.5943782 +1     5     1     3
  C     1.33389570 +1  102.2440459 +1   67.4753782 +1     3     1     2
  O     1.21346156 +1  120.8663353 +1   94.5364676 +1    12     3     1
  C     1.33281078 +1  102.8269266 +1  -68.2527085 +1     2     1     3
  O     1.21441321 +1  119.9900710 +1  -93.9443875 +1    14     2     1
  C     1.51166091 +1  115.1462507 +1  -91.6955245 +1    12     3     1
  C     1.50806664 +1  115.1173385 +1   91.9267898 +1    14     2     1
  C     1.55336664 +1  113.8024692 +1 -176.3503462 +1    16    12     3
  C     1.55204594 +1  114.4120330 +1  178.3452948 +1    17    14     2
  H     1.09765339 +1  113.8658004 +1   -5.7825325 +1    18    16    12
  H     1.09114145 +1  114.5709378 +1  119.2443316 +1    18    16    12
  H     1.09785587 +1  113.7307326 +1    7.5866126 +1    19    17    14
  H     1.09102470 +1  114.7036703 +1 -117.4062088 +1    19    17    14
  H     1.09953590 +1  110.5735075 +1   62.8751262 +1     6     4     1
  H     1.09722161 +1  113.0734843 +1 -174.5980249 +1     6     4     1
  H     1.11113909 +1  108.6442427 +1  -54.7334136 +1     6     4     1
  H     1.11826379 +1  108.4736288 +1  -56.4902341 +1     9     5     1
  H     1.09681433 +1  112.9976805 +1 -175.6545763 +1     9     5     1
  H     1.09749073 +1  110.9440459 +1   61.4714043 +1     9     5     1
  H     1.10996468 +1  107.4794786 +1   51.5790714 +1    17    14     2
  H     1.10889702 +1  107.6234888 +1  -49.5574258 +1    16    12     3