(2R)-2-[(1R)-1-{[(2Z)-2-(2-Amino-1,3-Thiazol-4-Yl)-2-(Methoxyimino)Acetyl]Amino}-2-Oxoethyl]-5-[(Z)-2-(4-Methyl-1,3-Thiazol-5-Yl)Vinyl]-3,6-Dihydro-2H-1,3-Thiazine-4-Carboxylic Acid

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Properties Simple | Detailed

Formula C19H20N6O5S3
IUPAC Name (2r)-2-[(1r)-1-[[(2z)-2-(2-aminothiazol-4-yl)-2-methoxyimino-acetyl]amino]-2-oxo-ethyl]-5-[(z)-2-(4-methylthiazol-5-yl)vinyl]-3,6-dihydro-2h-1,3-thiazine-4-carboxylic acid
Molecular Mass 508.594 g·mol−1
Heat of Formation -217.0 ± 16.7 kJ·mol−1
Dipole Moment 1.94 ± 1.08 D
Volume 562.05 Å 3
Surface Area 442.3 Å 2
HOMO Energy -8.74 ± 0.55 eV
LUMO Energy -0.97 ± eV
Point Group Symmetry C1
InChIKey XCLKPDQELZKNLK-KRRFQGJCSA-N
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