(2S,2'S)-5,5'-(1,9-Nonanediyldiimino)Bis{2-[(4-{[(2,4-Diamino-6-Pteridinyl)Methyl](Methyl)Amino}Benzoyl)Amino]-5-Oxopentanoic Acid}

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Formula C49H62N18O8
IUPAC Name (2s)-5-[9-[[(4s)-4-carboxy-4-[[4-[(2,4-diaminopteridin-6-yl)methyl-methyl-amino]benzoyl]amino]butanoyl]amino]nonylamino]-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methyl-amino]benzoyl]amino]-5-oxo-pentanoic acid
Molecular Mass 1031.132 g·mol−1
Heat of Formation -851.5 ± 16.7 kJ·mol−1
Dipole Moment 10.60 ± 1.08 D
Volume 1215.76 Å 3
Surface Area 1056.24 Å 2
HOMO Energy -8.67 ± 0.55 eV
LUMO Energy -1.17 ± eV
Point Group Symmetry C2
InChIKey FRPAIDUZEKEEIT-PXLJZGITSA-N
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