(2,5-Dimethyl-1,4-Phenylene)Bis(Methylene) Bis(N-Carbamimidoylcarbamimidothioate)

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Formula C14H22N8S2
IUPAC Name 1-carbamimidoyl-2-[[4-[(n-carbamimidoylcarbamimidoyl)sulfanylmethyl]-2,5-dimethyl-phenyl]methyl]isothiourea
Molecular Mass 366.508 g·mol−1
Heat of Formation 325.1 ± 16.7 kJ·mol−1
Dipole Moment 1.39 ± 1.08 D
Volume 424.34 Å 3
Surface Area 384.18 Å 2
HOMO Energy -7.90 ± 0.55 eV
LUMO Energy 3.47 ± eV
Point Group Symmetry C1
Synonyms
  • 1,4-bis-{[n-(1-imino-1guanidino-methyl)]sulfanylmethyl}-3,6-dimethyl-benzene
  • 4-({[(e)-{[(e)-amino(imino)methyl]amino}(imino)methyl]sulfanyl}methyl)-2,5-dimethylbenzyl n-[(e)-amino(imino)methyl]imidothiocarbamate
  • c1a
  • n-(diaminomethylene)-1-[[4-[(n-(diaminomethylene)carbamimidoyl)sulfanylmethyl]-2,5-dimethyl-phenyl]methylsulfanyl]formamidine
  • n-(diaminomethylene)-1-[[4-[[(guanidino-iminomethyl)thio]methyl]-2,5-dimethylphenyl]methylthio]formamidine
  • n-(diaminomethylene)-1-[[4-[[(n-(diaminomethylene)carbamimidoyl)thio]methyl]-2,5-dimethyl-benzyl]thio]formamidine
  • n-(diaminomethylidene)-1-[[4-[(n-(diaminomethylidene)carbamimidoyl)sulfanylmethyl]-2,5-dimethyl-phenyl]methylsulfanyl]methanimidamide
  • n-(diaminomethylidene)-1-[[4-[(n-(diaminomethylidene)carbamimidoyl)sulfanylmethyl]-2,5-dimethylphenyl]methylsulfanyl]methanimidamide
InChIKey UQMGTQSCMRRWFV-UHFFFAOYSA-N
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