Formula |
C23H26BrFN4O2 |
IUPAC Name |
4-bromo-n-[(1s)-2-[(1r)-1-(3-fluorophenyl)-4-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]-1-methyl-ethyl]benzamide |
Molecular Mass |
489.381 g·mol−1 |
Heat of Formation |
-314.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.77 ± 1.08 D |
Volume |
526.73 Å 3 |
Surface Area |
418.24 Å 2 |
HOMO Energy |
-8.85 ± 0.55 eV |
LUMO Energy |
2.52 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
RFKXAYJUFUZBMA-INIZCTEOSA-N |
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Links |
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Elements |
C
F
H
O
N
Br
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