7-(2,6-Dichlorophenyl)-5-Methyl-N-[4-[2-(1-Oxidopyrrolidin-1-Ium-1-Yl)Ethoxy]Phenyl]-1,2,4-Benzotriazin-3-Amine
Properties
Property | Value |
---|---|
Formula | C26H26Cl2N5O2+ |
IUPAC Name | 7-(2,6-dichlorophenyl)-n-[4-[2-(1-hydroxypyrrolidin-1-ium-1-yl)ethoxy]phenyl]-5-methyl-1,2,4-benzotriazin-3-amine |
Molecular Mass | 511.423 g·mol−1 |
Heat of Formation | 269.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.20 ± 1.08 D |
Volume | 577.56 Å 3 |
Surface Area | 496.75 Å 2 |
HOMO Energy | -8.37 ± 0.55 eV |
LUMO Energy | 1.90 ± eV |
Point Group Symmetry | C1 |
InChIKey | HWMIKFSQPKIUQH-UHFFFAOYSA-N |
QR Code | Generate QR Code |
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Elements | H C N O Cl |