Formula |
C8H10INO3S |
IUPAC Name |
(2s,5r,6r)-6-iodo-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate |
Molecular Mass |
327.139 g·mol−1 |
Heat of Formation |
651.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.05 ± 1.08 D |
Volume |
261.34 Å 3 |
Surface Area |
239.22 Å 2 |
HOMO Energy |
-8.69 ± 0.55 eV |
LUMO Energy |
0.59 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- (2s,5r,6r)-6-iodo-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
|
InChIKey |
XWDSFLSFDJZQTM-ALEPSDHESA-M |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
I
S
C
O
N
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