Formula |
C16H16N4O8S |
IUPAC Name |
(6s,7r)-3-(carbamoyloxymethyl)-7-[[(2z)-2-(2-furyl)-2-methoxyimino-acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid |
Molecular Mass |
424.385 g·mol−1 |
Heat of Formation |
-815.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.82 ± 1.08 D |
Volume |
455.03 Å 3 |
Surface Area |
404.46 Å 2 |
HOMO Energy |
-9.17 ± 0.55 eV |
LUMO Energy |
-0.87 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (6s,7r)-3-(aminocarbonyloxymethyl)-7-[[(2z)-2-furan-2-yl-2-methoxyimino-ethanoyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
- (6s,7r)-3-(carbamoyloxymethyl)-7-[[(2z)-2-(2-furyl)-2-methoxyimino-1-oxoethyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
- (6s,7r)-3-(carbamoyloxymethyl)-7-[[(2z)-2-(2-furyl)-2-methoxyimino-acetyl]amino]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
- (6s,7r)-3-(carbamoyloxymethyl)-7-[[(2z)-2-(2-furyl)-2-methoxyimino-acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
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InChIKey |
JFPVXVDWJQMJEE-NCEVBZPASA-N |
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Links |
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Elements |
H
S
C
O
N
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