| Formula |
C14H14N2O5S2 |
| IUPAC Name |
(6r,7r)-3-(hydroxymethyl)-8-oxo-7-[[2-(2-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid |
| Molecular Mass |
354.401 g·mol−1 |
| Heat of Formation |
-585.3 ± 16.7 kJ·mol−1 |
| Dipole Moment |
2.25 ± 1.08 D |
| Volume |
384.81 Å 3 |
| Surface Area |
324.34 Å 2 |
| HOMO Energy |
-9.26 ± 0.55 eV |
| LUMO Energy |
-0.73 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- (6r,7r)-3-(hydroxymethyl)-8-oxo-7-(2-thiophen-2-ylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
- (6r,7r)-3-(hydroxymethyl)-8-oxo-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
- (6r,7r)-3-(hydroxymethyl)-8-oxo-7-[[1-oxo-2-(2-thienyl)ethyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
- (6r,7r)-3-(hydroxymethyl)-8-oxo-7-[[2-(2-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
- (6r,7r)-8-keto-3-methylol-7-[[2-(2-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
- (6r-trans)-3-(hydroxymethyl)-8-oxo-7-(2-thienylacetamido)-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid
- desacetylcephalothin
|
| InChIKey |
HTBAVMIGXROYPQ-ZWNOBZJWSA-N |
| QR Code |
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| Links |
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|
| DOI |
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| Downloads |
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|
| Elements |
H
S
C
O
N
|
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