Formula |
C27H23N3O5 |
IUPAC Name |
4-[4-(4-aminophenyl)buta-1,3-diynyl]-n-[(1s,2s)-2-hydroxy-1-(hydroxycarbamoyl)-2-(4-hydroxyphenyl)propyl]benzamide |
Molecular Mass |
469.489 g·mol−1 |
Heat of Formation |
-89.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.97 ± 1.08 D |
Volume |
546.44 Å 3 |
Surface Area |
491.44 Å 2 |
HOMO Energy |
-8.45 ± 0.55 eV |
LUMO Energy |
-1.20 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
CXPNZJDYPDDMKA-SQHAQQRYSA-N |
QR Code |
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Elements |
H
C
O
N
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