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

azide    681 Azide

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    #  Species Formula
   671 Diphenyl diazeneC12H10N2
   672 4,4'-Dimethyl-2,2'-bipyridineC12H12N2
   673 1,(1-Piperidinyl) cyclohexanecarbonitrileC12H20N2
   674 Li(I)(Cp)N2 (SIJNII) (Geo)H23LiC12N2
   675 Li(I)(Cp)N2 (SIJNII)H23LiC12N2
   676 a-Phenyl-1-piperidineacetonitrileC13H16N2
   677 Li(I)N2C5 (FAGCAR) (Geo)H25LiC14N2
   678 Li(I)N2C5 (FAGCAR)H25LiC14N2
   679 2,2'-BiquinolineC18H12N2
   680 TetraisobutylsuccinonitrileC20H36N2
   681 Azide N3
   682 Azide (Geo)N3
   683 Hydrazoic acidHN3
   684 BorazoleH6B3N3
   685 Borazole (Geo)H6B3N3
   686 Methyl AzideCH3N3
   687 1,3,5-TriazineC3H3N3
   688 s-Triazine (Geo)C3H3N3
   689 EthylenetricarbonitrileHC5N3
   690 1,1,1-EthanetricarbonitrileC5H3N3
   691 TrisdimethylaminoboraneH18BC6N3


ΔHf: 99.0 kcal/mol,     REF: M. W. Chase, J. L. Curnutt, A. T. Hu, H. Prophet, A. N. Syverud, L. C. Walker, J. Phys. Chem. Ref. Data, 3, 311, (1974).
  
 UHF FIELD=(0.01,0.02,0.03) PULAY PM7
Azide
 H=99 HR=CCHP1974
  N     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  N     1.17972111 +1    0.0000000 +0    0.0000000 +0     1     0     0
  N     1.18012561 +1  179.8406544 +1    0.0000000 +0     2     1     0