Formula |
C13H19BClN2O6- |
IUPAC Name |
carbon dioxide; (2s,3r)-3-(4-chlorophenyl)-n-(oxiran-2-yl)oxiran-2-amine; 2-oxoboranyloxyacetonitrile |
Molecular Mass |
345.564 g·mol−1 |
Heat of Formation |
843.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
9.17 ± 1.08 D |
Volume |
354.41 Å 3 |
Surface Area |
329.82 Å 2 |
HOMO Energy |
-9.66 ± 0.55 eV |
LUMO Energy |
-0.96 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
RJXOEUFRQATKAB-VXGBXAGGSA-N |
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Links |
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Downloads |
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Elements |
C
N
B
O
Cl
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