N-({(1S)-5-[4-(13-{[2,4-Bis(Dihydroxyamino)Phenyl]Amino}-2,5,8,11-Tetraoxatridec-1-Yl)-1H-1,2,3-Triazol-1-Yl]-1-Carboxypentyl}Carbamoyl)-L-Glutamic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C29H46N8O15
IUPAC Name n-({(1s)-5-[4-(13-{[2,4-bis(dihydroxyamino)phenyl]amino}-2,5,8,11-tetraoxatridec-1-yl)-1h-1,2,3-triazol-1-yl]-1-carboxypentyl}carbamoyl)-l-glutamic acid
Molecular Mass 746.720 g·mol−1
Heat of Formation 2482.6 ± 16.7 kJ·mol−1
Dipole Moment 27.38 ± 1.08 D
Volume 777.92 Å 3
Surface Area 647.8 Å 2
HOMO Energy -8.83 ± 0.55 eV
LUMO Energy -3.31 ± eV
Point Group Symmetry C1
InChIKey OGVHLQGCHPCUQO-ZEQRLZLVSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C O N