(6R,7R)-7-[[(2Z)-2-(5-Amino-Blahcyclopent-3-En-3-Yl)-2-Methoxyimino-Acetyl]Amino]-3-(Imidazo[1,2-B]Pyridazin-8A-Id-1-Ylmethyl)-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylate

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Properties Simple | Detailed

Formula C19H21N9O5S2
IUPAC Name (6r,7r)-7-[[(2z)-2-(5-amino-blahcyclopent-3-en-3-yl)-2-methoxyimino-acetyl]amino]-3-(imidazo[1,2-b]pyridazin-8a-id-1-ylmethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Molecular Mass 519.557 g·mol−1
Heat of Formation 252.8 ± 16.7 kJ·mol−1
Dipole Moment 18.89 ± 1.08 D
Volume 542.3 Å 3
Surface Area 461.82 Å 2
HOMO Energy -8.45 ± 0.55 eV
LUMO Energy -2.36 ± eV
Point Group Symmetry C1
InChIKey YKPASVHTKXYPSN-OIVWSZGGSA-N
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