Accuracy

Pt(II)N4(2plus) (ACMPTC)   7670 Pt(II)N4(2+) (ACMPTC)

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    #  Species Formula
  7660 Platinum, atomPt
  7661 Cyclopentadienyl trimethyl platinumC8H14Pt
  7662 Pt(IV)(Cp)C3 (CPMEPT01) (Geo)C8H14Pt
  7663 Pt(IV)(Cp)C3 (CPMEPT01)C8H14Pt
  7664 Pt(II)(NH3)4 (Geo)H12N4Pt
  7665 Pt(II)N4(2+) (APTCPT) (Geo)H12N4Pt
  7666 Pt(II)N4(2+) (APTCPT)H12N4Pt
  7667 Pt(II)(NH3)6H18N6Pt
  7668 Pt(II)(NH3)6 (Geo)H18N6Pt
  7669 Pt(II)N4(2+) (ACMPTC) (Geo)C4H22N6Pt
  7670 Pt(II)N4(2+) (ACMPTC) C4H22N6Pt
  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


ΔHf: 330.7 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.
  
 CHARGE=2 UHF PM7
Pt(II)N4(2+) (ACMPTC)
 H=330.7 HR=PW91D
 Pt     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  N     2.05863106 +1    0.0000000 +0    0.0000000 +0     1     0     0
  N     2.04863029 +1   91.9572361 +1    0.0000000 +0     1     2     0
  N     2.04881494 +1   88.0247929 +1 -179.8239053 +1     1     2     3
  N     2.39135662 +1  105.6213836 +1  143.4396739 +1     2     1     3
  N     2.05916777 +1   91.8789488 +1  179.9631623 +1     1     4     2
  C     1.55014935 +1  115.3707875 +1   72.0457208 +1     6     1     3
  C     1.51805763 +1  109.7708169 +1  153.0608915 +1     7     6     1
  N     1.46813176 +1  104.8199339 +1  123.2097940 +1     7     6     8
  H     2.83168036 +1  136.4923324 +1  -96.1902354 +1     2     1     5
  H     1.77166621 +1   70.8655981 +1   57.2864784 +1    10     2     5
  H     1.74732196 +1   96.4926252 +1  -54.9704818 +1    10     2    11
  H     2.15248094 +1   89.4701453 +1   89.3159270 +1     2     1     3
  H     1.02769127 +1  109.0354569 +1  138.9593386 +1     2     1    13
  H     1.01571075 +1  112.5759244 +1  -95.1537617 +1     4     1     2
  H     1.01379156 +1  113.4117669 +1 -122.3889842 +1     4     1    15
  H     1.01829046 +1  139.8156985 +1  -52.9944800 +1     5     2     1
  H     1.01870164 +1  110.4407938 +1 -160.9530853 +1     5     2    17
  H     1.02312598 +1  110.6830867 +1  122.9472479 +1     6     1     7
  H     1.01367222 +1  113.7450955 +1   38.2115355 +1     3     1     2
  H     1.02960861 +1  109.4724374 +1  118.5539705 +1     3     1    20
  H     1.12905103 +1  105.8272325 +1  116.1035395 +1     7     6     9
  H     1.10924178 +1  111.2258581 +1  177.0249484 +1     8     7     6
  H     1.09994508 +1  113.6661171 +1  117.6298266 +1     8     7    23
  H     1.10105483 +1  114.1877508 +1  123.5106809 +1     8     7    24
  H     1.01884061 +1  113.5130632 +1  -91.2691814 +1     9     7     6
  H     1.01879075 +1  112.5141536 +1 -122.5730084 +1     9     7    26
  H     1.02341566 +1  110.7549639 +1  114.6331014 +1     2     1    14
  H     1.02958616 +1  109.2644974 +1 -117.9891625 +1     4     1    16
  H     1.02799620 +1  108.8613058 +1  114.5375147 +1     6     1    19
  H     1.01610114 +1  112.1065154 +1  119.2129326 +1     3     1    21
  C     1.09988456 +1   61.9740236 +1   16.2448056 +1    10     2    12
  C     1.12861638 +1   43.8662554 +1  149.3819247 +1    13     2     1