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

nitrate anion   1336 Nitrate anion

(Previous)     (Back)     (Next)        

   

    #  Species Formula
  1326 TriethoxyboraneH15BC6O3
  1327 m-Salicylic acidC7H6O3
  1328 o-Salicylic acidC7H6O3
  1329 p-Salicylic acidC7H6O3
  1330 2,3-Butanediol, 2,3-dimethyl-, monoformateC7H14O3
  1331 Trimethoxymethyl benzeneC10H14O3
  1332 1-tert-Butoxy-3-propoxy-2-propanolC10H22O3
  1333 1-Butoxy-3-tert-butyl-2-propanolC11H24O3
  1334 Benzoic acid, anhydrideC14H10O3
  1335 Nitrate radicalNO3
  1336 Nitrate anion NO3
  1337 Nitric acid (Geo)HNO3
  1338 Nitric acidHNO3
  1339 Methyl nitrateCH3NO3
  1340 Oxamic acidC2H3NO3
  1341 Ethyl nitrateC2H5NO3
  1342 SerineC3H7NO3
  1343 2-NitrofuranC4H3NO3
  1344 ThreonineC4H9NO3
  1345 m-NitrophenolC6H5NO3
  1346 o-NitrophenolC6H5NO3


ΔHf: -74.7 kcal/mol,     REF: D. D. Wagman, W. H. Evans, V. B. Parker, R. H. Schumm, I. Halow, S. M. Bailey, K. L. Churney, R. L. Nuttall, J. Phys. Chem. Ref. Data Suppl. 11, 2 (1982).
  
 CHARGE=-1 PM7
Nitrate anion
 H=-74.7 HR=WEPS1982
  N     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     1.24545686 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     1.24543827 +1  120.0135354 +1    0.0000000 +0     1     2     0
  O     1.24544799 +1  119.9903578 +1 -179.9998756 +1     1     2     3