(4-Nitrophenyl)Methanethiol

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Properties Simple | Detailed

Formula C7H7NO2S
IUPAC Name (4-nitrophenyl)methanethiol
Molecular Mass 169.201 g·mol−1
Heat of Formation 60.5 ± 16.7 kJ·mol−1
Dipole Moment 4.37 ± 1.08 D
Volume 192.27 Å 3
Surface Area 189.01 Å 2
HOMO Energy -9.37 ± 0.55 eV
LUMO Energy 1.54 ± eV
Point Group Symmetry C1
InChIKey QXPYWTDAIYFWTR-UHFFFAOYSA-N
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