N-(3,5-Dinitrobenzoyl)-L-Tyrosine

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Properties Simple | Detailed

Formula C16H13N3O8
IUPAC Name (2s)-2-[(3,5-dinitrobenzoyl)amino]-3-(4-hydroxyphenyl)propanoic acid
Molecular Mass 375.290 g·mol−1
Heat of Formation -570.7 ± 16.7 kJ·mol−1
Dipole Moment 4.17 ± 1.08 D
Volume 405.32 Å 3
Surface Area 361.97 Å 2
HOMO Energy -9.41 ± 0.55 eV
LUMO Energy 0.66 ± eV
Point Group Symmetry C1
InChIKey DCSVEDZIOSFADB-CQSZACIVSA-N
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