2-Methyl-2-Propanyl 6-{[2-Chloro-4-(Dimethylcarbamoyl)Phenyl]Amino}-2-(1,3-Oxazol-5-Yl)-1H-Pyrrolo[3,2-C]Pyridine-1-Carboxylate

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Properties Simple | Detailed

Formula C24H24ClN5O4
IUPAC Name tert-butyl 6-[2-chloro-4-(dimethylcarbamoyl)anilino]-2-oxazol-5-yl-pyrrolo[3,2-c]pyridin-1-ium-1-carboxylate
Molecular Mass 481.931 g·mol−1
Heat of Formation -316.1 ± 16.7 kJ·mol−1
Dipole Moment 7.54 ± 1.08 D
Volume 549.0 Å 3
Surface Area 468.01 Å 2
HOMO Energy -8.52 ± 0.55 eV
LUMO Energy 2.02 ± eV
Point Group Symmetry C1
InChIKey VGVIWBCNXYVLQY-UHFFFAOYSA-N
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Elements H C Cl O N