N-[2-(Bis{2-[(2,3-Dihydroxybenzoyl)Amino]Ethyl}Amino)Ethyl]-1-Hydroxy-6-Oxo-1,6-Dihydro-2-Pyridinecarboxamide

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Properties Simple | Detailed

Formula C26H29N5O9+
IUPAC Name n-[2-[bis[2-[(2,3-dihydroxybenzoyl)amino]ethyl]amino]ethyl]-1-hydroxy-2-oxo-3h-pyridin-1-ium-3-ide-6-carboxamide
Molecular Mass 555.537 g·mol−1
Heat of Formation -1183.2 ± 16.7 kJ·mol−1
Dipole Moment 3.72 ± 1.08 D
Volume 630.49 Å 3
Surface Area 555.6 Å 2
HOMO Energy -9.08 ± 0.55 eV
LUMO Energy -0.98 ± eV
Point Group Symmetry C1
InChIKey SHTLBAYLLAIJDF-UHFFFAOYSA-N
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