diff --git a/assets/docs/synthesis/molecules/molecules-procedural/desc/ArCmCuHMnOOsPaPtSeTmYb.html b/assets/docs/synthesis/molecules/molecules-procedural/desc/ArCmCuHMnOOsPaPtSeTmYb.html
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Formula | ArCmCuHMnOOsPaPtSeTmYb | | |
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Molecular weight | 1212.7134 u | | |
Hydrogen bond donors | 0 | | |
Hydrogen bond acceptors | 4 | | |
Percent composition | | |
Ar 39.948 u × 1 NaN % |
Cm undefined u × 1 NaN % |
Cu 63.546 u × 1 NaN % |
H 1.00794 u × 1 NaN % |
Mn 54.938046 u × 1 NaN % |
O 15.9994 u × 1 NaN % |
Os 190.23 u × 1 NaN % |
Pa undefined u × 1 NaN % |
Pt 195.084 u × 1 NaN % |
Se 78.96 u × 1 NaN % |
Tm undefined u × 1 NaN % |
Yb undefined u × 1 NaN % |
| | |
Canonical SMILES | [O-3]([Pt+4][Mn][Se-][Pa--])[H+3][Cu][Yb][Cm+4][Tm-3][Os+][Ar++] | | |
Isomeric SMILES | [Pa-2][Se-][Mn][Pt+4][O-3][H+3][Cu][Yb][Cm+4][Tm-3][Os+][Ar+2] | | |
InChIKey | KJIIUCGLTYVLED-UHFFFAOYSA-N | | |
InChI | InChI=1S/Ar.Cm.Cu.Mn.HO.Os.Pa.Pt.Se.Tm.Yb/h;;;;1H;;;;;;/q+2;+4;;;;+1;-2;+4;-1;-3; | | |
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diff --git a/assets/docs/synthesis/molecules/molecules-procedural/desc/C3H8N4O7.html b/assets/docs/synthesis/molecules/molecules-procedural/desc/C3H8N4O7.html
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+Formula | C3H8N4O7 | | |
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Molecular weight | 212.1188 u | | |
Hydrogen bond donors | 3 | | |
Hydrogen bond acceptors | 9 | | |
Percent composition | | |
C 12.0107 u × 3 16.987 % |
H 1.00794 u × 8 3.8014 % |
N 14.0067 u × 4 26.413 % |
O 15.9994 u × 7 52.799 % | | |
Canonical SMILES | [C-3]C[OH2++][C--][NH2+][N-][O-3][O+]O[O-][N-4][NH2+]O[O-] | | |
Isomeric SMILES | [O-]O[N+][N-4][O-]O[O+][O-3][N-][N+][C-2][O+2]C[C-3] | | |
InChIKey | VDQOGOGVZVNLLW-UHFFFAOYSA-M | | |
InChI | InChI=1S/C3H9N4O7/c1-2-9-3-4-5-11-13-14-12-7-6-10-8/h8H,2,4,6,9H2/q-9/p-1 | | |
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diff --git a/assets/docs/synthesis/molecules/molecules-procedural/desc/CH10Cl2F2N3O2P2S.html b/assets/docs/synthesis/molecules/molecules-procedural/desc/CH10Cl2F2N3O2P2S.html
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+Formula | CH10Cl2F2N3O2P2S | | |
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Molecular weight | 299.0192 u | | |
Hydrogen bond donors | 4 | | |
Hydrogen bond acceptors | 5 | | |
Percent composition | | |
C 12.0107 u × 1 4.0166 % |
H 1.00794 u × 10 3.3708 % |
Cl 35.453 u × 2 23.712 % |
F 18.998404 u × 2 12.707 % |
N 14.0067 u × 3 14.052 % |
O 15.9994 u × 2 10.701 % |
P 30.973763 u × 2 20.717 % |
S 32.065 u × 1 10.723 % | | |
Canonical SMILES | N[F]NS[F]PPC[ClH].ONO[ClH] | | |
Isomeric SMILES | O([H])N([H])OCl[H]ClCP([H])P([H])FSN([H])FN([H])[H] | | |
InChIKey | HNVBNBFUUPRVCL-UHFFFAOYSA-N | | |
InChI | InChI=1S/CH10Cl2F2N3O2P2S/c6-4-7-13-5-12-11-1-2-14-3-10-8-9/h7-9,11-12H,1,6H2 | | |
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diff --git a/assets/docs/synthesis/molecules/molecules-procedural/desc/CH7N2O2.html b/assets/docs/synthesis/molecules/molecules-procedural/desc/CH7N2O2.html
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+Formula | CH7N2O2 | | |
---|
Molecular weight | 79.0785 u | | |
Hydrogen bond donors | 3 | | |
Hydrogen bond acceptors | 3 | | |
Percent composition | | |
C 12.0107 u × 1 15.188 % |
H 1.00794 u × 7 8.9223 % |
N 14.0067 u × 2 35.425 % |
O 15.9994 u × 2 40.465 % | | |
Canonical SMILES | NC[O](N)O | | |
Isomeric SMILES | N([H])([H])CO(N([H])[H])O[H] | | |
InChIKey | OYHFORUHCIVFLZ-UHFFFAOYSA-N | | |
InChI | InChI=1S/CH7N2O2/c2-1-5(3)4/h4H,1-3H2 | | |
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diff --git a/assets/docs/synthesis/molecules/molecules-procedural/desc/ClHCCHSFHOCNOO.html b/assets/docs/synthesis/molecules/molecules-procedural/desc/ClHCCHSFHOCNOO.html
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+Formula | C3H11ClFNO3S | | |
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Molecular weight | 195.6362 u | | |
Hydrogen bond donors | 2 | | |
Hydrogen bond acceptors | 4 | | |
Percent composition | | |
C 12.0107 u × 3 18.417 % |
H 1.00794 u × 11 5.6672 % |
Cl 35.453 u × 1 18.121 % |
F 18.998404 u × 1 9.7109 % |
N 14.0067 u × 1 7.1594 % |
O 15.9994 u × 3 24.534 % |
S 32.065 u × 1 16.390 % | | |
Canonical SMILES | Cl.CC.OCNOO.[FH]S | | |
Isomeric SMILES | Cl[H]CC[H]SF[H]OCN([H])OO[H] | | |
InChIKey | SWJZROQGLFUSOX-UHFFFAOYSA-N | | |
InChI | InChI=1S/C3H11ClFNO3S/c4-11-1-2-12-10-5-13-8-3-6-9-7/h6-7H,1-3H2 | | |
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