Formula |
C28H29Cl2N5 |
IUPAC Name |
(1r)-n'-[5-chloro-2-(5-chloro-2-pyridyl)-6-methyl-pyrimidin-4-yl]-1-phenyl-n-(4-phenylbutyl)ethane-1,2-diamine |
Molecular Mass |
506.469 g·mol−1 |
Heat of Formation |
347.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.97 ± 1.08 D |
Volume |
608.1 Å 3 |
Surface Area |
538.32 Å 2 |
HOMO Energy |
-8.91 ± 0.55 eV |
LUMO Energy |
1.87 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
UZZVALJVPJZKDU-VWLOTQADSA-N |
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Elements |
H
C
Cl
N
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