Accuracy

di-t-butyl zinc   3717 Di-t-butyl zinc

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    #  Species Formula
  3707 Ethyl zincC2H5Zn
  3708 Dimethyl zincC2H6Zn
  3709 Diethyl zincC4H10Zn
  3710 Diethylzinc (Geo)C4H10Zn
  3711 Zn(II)C4(2-) (LTMEZN) (Geo)C4H12Zn
  3712 Zn(II)C4(2-) (LTMEZN)C4H12Zn
  3713 Cyclopentadienylmethylzinc (Geo)C6H8Zn
  3714 Di-n-propyl zincC6H14Zn
  3715 Di-n-propylzinc (Geo)C6H14Zn
  3716 Di-n-butyl zincC8H18Zn
  3717 Di-t-butyl zinc C10H22Zn
  3718 Zn(II)N4(2+) (FUZCUY) (Geo)H12N4Zn
  3719 Zn(II)N4(2+) (FUZCUY)H12N4Zn
  3720 Zn(II)(En)3C6H24N6Zn
  3721 Zn(II)(En)3 (Geo)C6H24N6Zn
  3722 Zn(II)N6(2+) (CIBKIH) (Geo)C6H24N6Zn
  3723 Zn(II)N6(2+) (CIBKIH)C6H24N6Zn
  3724 Zn[(C6H9)(NH2)3]2(++)C12H30N6Zn
  3725 Zn[(C6H9)(NH2)3]2(++) (Geo)C12H30N6Zn
  3726 ZnN3O2C16H11N5O4Zn
  3727 ZnN3O2 (Geo)C16H11N5O4Zn


ΔHf: -28.9 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
Di-t-butyl zinc
 H=-28.85 HR=NIST
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Zn     2.00969781 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     2.00975979 +1  179.0000000 +0    0.0000000 +0     2     1     0
  C     1.51929880 +1  113.7113118 +1  -92.8114646 +1     3     2     1
  C     1.51916115 +1  113.8080213 +1  133.1977402 +1     1     2     4
  C     1.54422851 +1  110.9620184 +1   60.8230426 +1     5     1     2
  C     1.54575692 +1  109.4584895 +1 -179.7325131 +1     5     1     2
  C     1.54425908 +1  110.9094643 +1  -60.3805686 +1     5     1     2
  C     1.54422676 +1  110.9299588 +1   61.4079558 +1     4     3     2
  C     1.54575394 +1  109.4665192 +1 -179.2150351 +1     4     3     2
  C     1.54417289 +1  110.9492430 +1  -59.7809584 +1     4     3     2
  H     1.09063975 +1  104.9214903 +1  -20.2811973 +1     1     2    11
  H     1.09012295 +1  105.2559743 +1 -134.6144453 +1     1     2    11
  H     1.09029762 +1  105.1529092 +1  152.5119729 +1     3     2    11
  H     1.09042437 +1  105.1156132 +1  -93.1062270 +1     3     2    11
  H     1.09401732 +1  111.1331385 +1  177.8502201 +1     6     5     1
  H     1.09426530 +1  110.8861469 +1   58.3509090 +1     6     5     1
  H     1.09467185 +1  111.7878929 +1  -62.0893098 +1     6     5     1
  H     1.09364717 +1  110.8692864 +1   59.5221568 +1     7     5     1
  H     1.09362816 +1  110.8790242 +1  -59.7298971 +1     7     5     1
  H     1.09234432 +1  111.7519930 +1  179.8934276 +1     7     5     1
  H     1.09397762 +1  111.1434449 +1 -177.7219243 +1     8     5     1
  H     1.09484077 +1  111.7710595 +1   62.2242229 +1     8     5     1
  H     1.09430022 +1  110.8870521 +1  -58.2039026 +1     8     5     1
  H     1.09402253 +1  111.1433084 +1  177.9433731 +1     9     4     3
  H     1.09426962 +1  110.8859791 +1   58.4348267 +1     9     4     3
  H     1.09463800 +1  111.7807541 +1  -61.9899113 +1     9     4     3
  H     1.09237472 +1  111.7421598 +1 -179.7653104 +1    10     4     3
  H     1.09367183 +1  110.8769568 +1   59.8628171 +1    10     4     3
  H     1.09366970 +1  110.8736763 +1  -59.3957901 +1    10     4     3
  H     1.09401124 +1  111.1431794 +1 -177.9214788 +1    11     4     3
  H     1.09495049 +1  111.7754950 +1   62.0357102 +1    11     4     3
  H     1.09435014 +1  110.8965621 +1  -58.3948144 +1    11     4     3