N,N-Bis{2-[(Carboxymethyl){2-Oxo-2-[(2-Sulfanylethyl)Amino]Ethyl}Amino]Ethyl}Glycine

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Properties Simple | Detailed

Formula C18H33N5O8S2
IUPAC Name 2-[bis[2-[carboxymethyl-[2-oxo-2-(2-sulfanylethylamino)ethyl]amino]ethyl]amino]acetic acid
Molecular Mass 511.613 g·mol−1
Heat of Formation -1514.5 ± 16.7 kJ·mol−1
Dipole Moment 4.58 ± 1.08 D
Volume 613.03 Å 3
Surface Area 485.79 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy 2.70 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[bis[2-[carboxymethyl-[2-(2-mercaptoethylamino)-2-oxoethyl]amino]ethyl]amino]acetic acid
  • 2-[bis[2-[carboxymethyl-[2-keto-2-(2-mercaptoethylamino)ethyl]amino]ethyl]amino]acetic acid
  • 2-[bis[2-[carboxymethyl-[2-oxo-2-(2-sulfanylethylamino)ethyl]amino]ethyl]amino]ethanoic acid
  • 7,10,13-tri(carboxymethyl)-5,15-dioxo-4,7,10,13,16-pentaaza-1,19-dithianonadecane
  • yma
InChIKey MRDWXQKAAKNXSP-UHFFFAOYSA-N
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