PM7 Accuracy Date:Mon Feb 11 04:20:05 2019

Pt(II)N2ClO (ACHGLP10)   7712 Pt(II)N2ClO (ACHGLP10)

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    #  Species Formula
  7702 cis-Pt(SMe2)2(C6H5)2 (Geo)C16H22S2Pt
  7703 Platinum(cyclooctadiene) maleonitriledithiolato (Geo)C12H12N2S2Pt
  7704 Platinum(cyclooctadiene) maleonitriledithiolatoC12H12N2S2Pt
  7705 Pt(Cyclo-octadiene) maleonitriledithiolato (Geo)C12H12N2S2Pt
  7706 cis-Pt(PEt3)2(SEt)2C16H40P2S2Pt
  7707 Pt(III)S4(-) (BEKSIT) (Geo)C8N4S4Pt
  7708 Pt(III)S4(-) (BEKSIT)C8N4S4Pt
  7709 Methyl platinum(II) chlorideCH3ClPt
  7710 Methyl platinum(II) chloride (Geo)CH3ClPt
  7711 Pt(II)N2ClO (ACHGLP10) (Geo)C2H7N2O2ClPt
  7712 Pt(II)N2ClO (ACHGLP10) C2H7N2O2ClPt
  7713 cis-Pt(PEt3)2Cl(CH3)C13H33P2ClPt
  7714 cis-Pt(PEt3)2Cl(2-Tol)C19H37P2ClPt
  7715 Pt(II)C4Cl2 (BOFTEV) (Geo)C4H8Cl2Pt
  7716 Pt(II)C4Cl2 (BOFTEV)C4H8Cl2Pt
  7717 Pt(cyclooctadiene)Cl2C8H12Cl2Pt
  7718 Pt(II)Cl2NC2 (ETDMAX) (Geo)C4H9NCl2Pt
  7719 Pt(II)Cl2NC2 (ETDMAX)C4H9NCl2Pt
  7720 Cis-Pt(NH3)2Cl2H6N2Cl2Pt
  7721 Pt(II)N2Cl2 (CUKRAB) (Geo)H6N2Cl2Pt
  7722 Pt(II)N2Cl2 (CUKRAB)H6N2Cl2Pt


ΔHf: -99.0 kcal/mol,     REF: Estimated from DGauss results of DFT calculations, using the B88-PW91 functional and the DZVP basis set, in CAChe 6.0, Fujitsu Ltd, 2003.
  
 UHF PM7
Pt(II)N2ClO (ACHGLP10)
 H=-99.0 HR=PW91D
 Pt     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Cl     2.26255539 +1    0.0000000 +0    0.0000000 +0     1     0     0
  N     2.06972411 +1   78.5511188 +1    0.0000000 +0     1     2     0
  N     2.07069384 +1  179.2857922 +1   -0.9928824 +1     1     2     3
  O     2.01720441 +1  100.9102129 +1  178.6203130 +1     1     2     3
  O     2.22192562 +1  143.8474955 +1  158.3536802 +1     5     1     2
  C     1.49767500 +1  109.0971138 +1 -153.5090487 +1     4     1     3
  C     1.20611901 +1   28.6811443 +1    5.8861144 +1     6     5     1
  H     1.00516925 +1  112.7492994 +1 -179.8041058 +1     3     1     2
  H     1.01598410 +1  111.1196503 +1 -120.4118508 +1     3     1     9
  H     1.01589860 +1  111.1463714 +1 -119.0996538 +1     3     1    10
  H     1.01488658 +1  112.8346485 +1  121.6274391 +1     4     1     7
  H     1.02076291 +1  109.2750821 +1  118.9966174 +1     4     1    12
  H     1.10868757 +1  110.9150412 +1   86.0920620 +1     7     4     1
  H     1.10456831 +1  113.3364617 +1  120.3751712 +1     7     4    14