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

methylmercuric bromide   7946 Methylmercuric bromide

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    #  Species Formula
  7936 Hg(II)Cl2S2 (CTSCHG)C2H10N6S2Cl2Hg
  7937 Hg(II)Cl3(-) (DOTLIH) (Geo)Cl3Hg
  7938 Hg(II)Cl3(-) (DOTLIH)Cl3Hg
  7939 Hg(II)Cl4(2-) (BEGZIW) (Geo)Cl4Hg
  7940 Hg(II)Cl4(2-) (BEGZIW)Cl4Hg
  7941 [Hg(II)Cl4](=)Cl4Hg
  7942 [Hg(II)Cl4](=) (Geo)Cl4Hg
  7943 Mercury bromide (Geo)BrHg
  7944 Mercury bromideBrHg
  7945 Methylmercuric bromide (Geo)CH3BrHg
  7946 Methylmercuric bromide CH3BrHg
  7947 Ethylmercuric bromideC2H5BrHg
  7948 Hg(II)Br2 (ACNHGB) (Geo)Br2Hg
  7949 Hg(II)Br2 (ACNHGB)Br2Hg
  7950 Mercury dibromide (Geo)Br2Hg
  7951 Mercury dibromideBr2Hg
  7952 18-Crown-6-dibromo-mercury(ii) (POLKEG) (Geo)C12H24O6Br2Hg
  7953 Hg(II)Br4(2-) (BOPGOC11) (Geo)Br4Hg
  7954 Hg(II)Br4(2-) (BOPGOC11)Br4Hg
  7955 Mercury iodide (Geo)IHg
  7956 Methylmercuric iodide (Geo)CH3IHg


ΔHf: -4.4 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).
Dipole: 3.1 Debye,     REF: A. L. McClellan, "Tables of Experimental Dipole Moments," Vol 2, Rahara Enterprises, El Cerrito, (1974).
I.P.: 9.2 eV,     REF: J. H. D. Elan, Int. J. Mass Spect. Ion Phys. 4, 37 (1970).
  
 PM7
Methylmercuric bromide
 H=-4.4 HR=WEPS1982 D=3.10 DR=MCC1974 I=9.25 IR=E1970
 Hg     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     2.05279604 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Br     2.40805455 +1  180.0000000 +0    0.0000000 +0     1     2     0
  H     1.09812601 +1  111.6433226 +1    0.0000000 +0     2     1     3
  H     1.09813671 +1  111.6454993 +1  119.9785245 +1     2     1     4
  H     1.09812800 +1  111.6661540 +1 -120.0132881 +1     2     1     4