Accuracy

1-hydroxy-2,2,6,6-tetramethyl-4-piperidinol   1104 1-Hydroxy-2,2,6,6-tetramethyl-4-piperidinol

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    #  Species Formula
  1094 2-Nitro-m-xyleneC8H9NO2
  1095 2,6-DimethylnitrobenzeneC8H9NO2
  1096 N-PhenylglycineC8H9NO2
  1097 8-Aminocaprylic acidC8H17NO2
  1098 2-Methyl-1H-isoindole-1,3(2H)-dioneC9H7NO2
  1099 NitromesityleneC9H11NO2
  1100 PhenylalanineC9H11NO2
  1101 2,2,6,6-Tetramethyl-4-oxo-1-piperidinyloxyC9H16NO2
  1102 1-Hydroxy-2,2,6,6-tetramethyl-4-piperidinoneC9H17NO2
  1103 4-Hydroxy-2,2,6,6-tetramethyl-1-piperidinyloxyC9H18NO2
  1104 1-Hydroxy-2,2,6,6-tetramethyl-4-piperidinol C9H19NO2
  1105 1-Nitroso-2-naphthalenolC10H7NO2
  1106 1-Nitroso-4-naphthalenolC10H7NO2
  1107 2-Nitroso-1-naphthalenolC10H7NO2
  1108 N,N-Dimethyl 4-methoxybenzamideC10H13NO2
  1109 1-NitroadamantaneC10H15NO2
  1110 2-NitroadamantaneC10H15NO2
  1111 Phenol, 2-[(phenylimino)methyl]-, N-oxideC13H11NO2
  1112 Benzenamine, N-[(4-methoxyphenyl)methylene]-, N-oxideC14H13NO2
  1113 N-(3-Phenoxy-2-hydroxypropyl)anilineC15H17NO2
  1114 NH2-NO2 (Geo)H2N2O2


ΔHf: -82.5 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.
  

1-Hydroxy-2,2,6,6-tetramethyl-4-piperidinol
 H=-82.5 HR=NIST
  N(HETATM    1  N   HET A   1)  -0.00626472 +1   0.00635718 +1   0.00544232 +1
  C(HETATM    2  C1  HET A   1)   1.50095274 +1   0.01177729 +1   0.00678696 +1
  C(HETATM    3  C2  HET A   1)   1.96633979 +1   1.48267614 +1   0.01068363 +1
  C(HETATM    4  C3  HET A   1)   1.34560521 +1   2.26290036 +1  -1.15821387 +1
  C(HETATM    5  C4  HET A   1)  -0.18539661 +1   2.23653172 +1  -1.03296770 +1
  C(HETATM    6  C5  HET A   1)  -0.72681641 +1   0.79175857 +1  -1.06009370 +1
  C(HETATM    7  C6  HET A   1)   1.91462374 +1  -0.65335650 +1   1.33590227 +1
  C(HETATM    8  C7  HET A   1)   2.14603688 +1  -0.76070011 +1  -1.15752297 +1
  C(HETATM    9  C8  HET A   1)  -2.20967540 +1   0.80305529 +1  -0.63446836 +1
  C(HETATM   10  C9  HET A   1)  -0.61892657 +1   0.19568521 +1  -2.47490096 +1
  O(HETATM   11  O1  HET A   1)  -0.47662948 +1  -1.31675200 +1   0.01925141 +1
  O(HETATM   12  O2  HET A   1)   1.81266714 +1   3.59286149 +1  -1.16432400 +1
  H(HETATM   13 1H2  HET A   1)   3.07213252 +1   1.52711259 +1  -0.04299701 +1
  H(HETATM   14 2H2  HET A   1)   1.68266029 +1   1.95948479 +1   0.97314508 +1
  H(HETATM   15 1H4  HET A   1)  -0.64585473 +1   2.82436578 +1  -1.85180288 +1
  H(HETATM   16 2H4  HET A   1)  -0.49148608 +1   2.72993512 +1  -0.08589733 +1
  H(HETATM   17 1H6  HET A   1)   1.40389777 +1  -0.17505317 +1   2.18836973 +1
  H(HETATM   18 2H6  HET A   1)   1.62308675 +1  -1.71617286 +1   1.35185326 +1
  H(HETATM   19 3H6  HET A   1)   2.99791272 +1  -0.58500186 +1   1.49364651 +1
  H(HETATM   20 1H7  HET A   1)   1.78708864 +1  -1.80010313 +1  -1.20239918 +1
  H(HETATM   21 2H7  HET A   1)   1.95376575 +1  -0.28621400 +1  -2.13219993 +1
  H(HETATM   22 3H7  HET A   1)   3.23921416 +1  -0.80457494 +1  -1.02742218 +1
  H(HETATM   23 1H8  HET A   1)  -2.63863721 +1  -0.21155631 +1  -0.67161538 +1
  H(HETATM   24 2H8  HET A   1)  -2.31599464 +1   1.15073053 +1   0.40690903 +1
  H(HETATM   25 3H8  HET A   1)  -2.80342054 +1   1.45818047 +1  -1.28381986 +1
  H(HETATM   26 1H9  HET A   1)   0.41038134 +1   0.22867544 +1  -2.86401730 +1
  H(HETATM   27 2H9  HET A   1)  -0.96616938 +1  -0.84832113 +1  -2.50171621 +1
  H(HETATM   28 3H9  HET A   1)  -1.25100371 +1   0.76171360 +1  -3.17752798 +1
  H(HETATM   29  H2  HET A   1)   1.60185726 +1   4.07639481 +1  -0.36554294 +1
  H(HETATM   30  H3  HET A   1)   1.69911408 +1   1.89905590 +1  -2.14863078 +1
  H(HETATM   31  H1  HET A   1)  -0.23051561 +1  -1.78770336 +1  -0.81779536 +1