Chem Imidacloprid Meghamani

Compound 16
  CheckMol                        TMF02:r0:m0
MF=C9H10ClN5O2 MW=255.66
 17 18  0  2  0               999 V2000
    0.0000   -0.0000   -0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.2948    1.4740   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.8254    2.4881   -0.0000 N   0 00  0  0  0  0  0  0  0  0  0  0
    1.7098    1.9457   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.5306    3.9621   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.0046    3.4197   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    0.8844    4.4338   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.1792    5.9078   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0590    6.9219   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2005    8.4195   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4150    6.6271   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1792    9.0444   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4858    9.1741   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1697    7.9360   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7711    8.4312   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7593    6.9455   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0564    9.1859   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3 02  0  1  0  0
  2  4 01  0  1  0  0
  3  5 01  0  1  0  0
  4  6 02  0  1  0  0
  5  7 02  0  1  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  1  0  0
  9 11  1  0  1  0  0
 10 12  2  0  1  0  0
 10 13  1  0  0  0  0
 11 14  1  0  1  0  0
 13 15  1  0  0  0  0
 15 16  2  0  0  0  0
 15 17  1  0  0  0  0
  6  7 01  0  1  0  0
 12 14  1  0  1  0  0
M  CHG  1  15   1
M  CHG  1  17  -1
M  END

Imidacloprid

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Chemical Name - Imidacloprid
Mol Weight - 255.664
Smiles - [O-][N+](NC1=NCCN1Cc(cc1)cnc1Cl)=O

Property Name	Property Value
Mol Name	Imidacloprid
Molweight	255.664
Monoisotopic Mass	255.052302
Clogp	-0.3445
Clogs	-2.39
H Acceptors	7
H Donors	1
Total Surface Area	183.62
Relative Psa	0.36984
Polar Surface Area	86.34
Druglikeness	1.2814
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.64706
Molecular Flexibility	0.5325
Molecular Complexity	0.69426
Fragments	1
Non H Atoms	17
Non Ch Atoms	8
Electronegative Atoms	8
Rotatable Bonds	2
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3 Atoms	4
Aromatic Nitrogens	1
Basic Nitrogens	1
Acidic Oxygens	1
Smiles	[O-][N+](NC1=NCCN1Cc(cc1)cnc1Cl)=O
InChIKey	InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)
InChI	YWTYJOPNNQFBPC-UHFFFAOYSA-N

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Imidacloprid