(2R)-2-[(1R)-2-[(2S)-2-Amino-2-Carboxy-Ethoxy]-2-Oxo-1-[[2-(2-Thienyl)Acetyl]Amino]Ethyl]-5-[(E)-2-(2,4-Dinitrophenyl)Vinyl]-3,6-Dihydro-2H-1,3-Thiazine-4-Carboxylic Acid

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Properties Simple | Detailed

Formula C24H23N5O11S2
IUPAC Name (2r)-2-[(1r)-2-[(2s)-2-amino-2-carboxy-ethoxy]-2-oxo-1-[[2-(2-thienyl)acetyl]amino]ethyl]-5-[(e)-2-(2,4-dinitrophenyl)vinyl]-3,6-dihydro-2h-1,3-thiazine-4-carboxylic acid
Molecular Mass 621.596 g·mol−1
Heat of Formation -952.6 ± 16.7 kJ·mol−1
Dipole Moment 6.93 ± 1.08 D
Volume 661.6 Å 3
Surface Area 532.32 Å 2
HOMO Energy -9.08 ± 0.55 eV
LUMO Energy -2.10 ± eV
Point Group Symmetry C1
InChIKey RMVBQKBMUOPBPA-DEKCOHRESA-N
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