Accuracy

Copper cis-diglycine   3632 Copper cis-diglycine

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    #  Species Formula
  3622 Cu-O (Geo)OCu
  3623 Cu(+) - H2O (Geo)H2OCu
  3624 Cu(+) - CH2O (Geo)CH2OCu
  3625 Cu(+) - CH3OH (Geo)CH4OCu
  3626 Copper (OH)2(H2O) (Geo)H4O3Cu
  3627 Cu(I)(H2O)4 (Geo)H8O4Cu
  3628 Cu(Acac)2C10H14O4Cu
  3629 Cu(II)O4 (ACACCU) (Geo)C10H14O4Cu
  3630 Cu(II)O4 (ACACCU)C10H14O4Cu
  3631 Copper cis-diglycine (Geo)C4H8N2O4Cu
  3632 Copper cis-diglycine C4H8N2O4Cu
  3633 Cu(II)O4N2 (CUAMAC) (Geo)C4H12N2O4Cu
  3634 Cu(II)O4N2 (CUAMAC)C4H12N2O4Cu
  3635 Copper - 3N plus 2O (Geo)C16H11N5O4Cu
  3636 Cu(II)N4(2+) (BUKPOM) (Geo)C4H12N8O4Cu
  3637 Cu(III)N4(-) (BIPLUH) (Geo)C8H12N8O4Cu
  3638 Cu(III)N4(-) (BIPLUH)C8H12N8O4Cu
  3639 Cu(II)(H2O)6H12O6Cu
  3640 Cu(II)(H2O)6 (Geo)H12O6Cu
  3641 Copper(ii) nitrate (Geo)N2O6Cu
  3642 Cu(II)O4N2 (ABCOPD) (Geo)C8H20N2O6Cu


ΔHf: 0.0 kcal/mol,     REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.
  
 PM7
Copper cis-diglycine
 H= HR=NIST
 Cu     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     1.76765044 +1    0.0000000 +0    0.0000000 +0     1     0     0
  N     2.11359416 +1  137.0963715 +1  180.0000000 +0     1     2     0
  N     2.09321986 +1   84.6520917 +1 -102.7432337 +1     1     2     3
  H     1.02313000 +1  113.3247330 +1 -153.8633571 +1     4     1     2
  H     1.01606938 +1  119.0814428 +1 -127.7175955 +1     4     1     5
  O     3.60042431 +1   77.9853219 +1  -66.6454968 +1     3     1     4
  C     1.20335476 +1   18.8785091 +1  -17.4962301 +1     7     3     1
  C     1.49065819 +1  100.4722100 +1   16.5606338 +1     3     1     7
  H     1.10698951 +1  113.6354411 +1 -152.6807364 +1     9     3     1
  H     1.01887147 +1  118.9843944 +1  119.8288951 +1     3     1     9
  H     1.02275067 +1  112.5813878 +1  124.3978402 +1     3     1    11
  H     1.10528506 +1  111.3003306 +1 -119.0162899 +1     9     3    10
  H     2.18326445 +1  123.0139020 +1 -110.2170012 +1     4     1     6
  O     1.28101160 +1  128.0831342 +1 -173.6521183 +1     8     7     3
  O     2.23511290 +1  142.5949271 +1  -50.7936800 +1     2     1    15
  C     1.20097729 +1   27.2595413 +1   -6.7474243 +1    16     2     1
  C     1.10163742 +1   38.5966123 +1  -15.5947811 +1    14     4     1
  H     1.11232353 +1  105.8845414 +1 -121.0777703 +1    18    14     4