2-({(1Z)-3-[(2,4-Dinitrophenyl)Amino]Propanimidoyl}Oxy)Ethanesulfonic Acid

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Properties Simple | Detailed

Formula C11H16N4O8S
IUPAC Name 2-sulfoethyl 3-(2,4-dinitroanilino)propanimidate
Molecular Mass 364.332 g·mol−1
Heat of Formation -638.8 ± 16.7 kJ·mol−1
Dipole Moment 9.57 ± 1.08 D
Volume 373.29 Å 3
Surface Area 350.12 Å 2
HOMO Energy -9.73 ± 0.55 eV
LUMO Energy -1.89 ± eV
Point Group Symmetry C1
InChIKey VDEZIBJYVHDTSE-QXMHVHEDSA-N
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