3-({Amino[Bis(2-Chloroethyl)Amino]Phosphoryl}Oxy)-1,1-Propanediyl Diacetate

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Properties Simple | Detailed

Formula C11H21Cl2N2O6P
IUPAC Name [1-acetoxy-3-[amino-[bis(2-chloroethyl)amino]phosphoryl]oxy-propyl] acetate
Molecular Mass 379.174 g·mol−1
Heat of Formation -1484.7 ± 16.7 kJ·mol−1
Dipole Moment 4.10 ± 1.08 D
Volume 410.72 Å 3
Surface Area 320.03 Å 2
HOMO Energy -9.12 ± 0.55 eV
LUMO Energy 0.19 ± eV
Point Group Symmetry C1
InChIKey QSXPVYOILSESJY-JOCHJYFZSA-N
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Elements C Cl H O N P