Geometry & MOs

Info

ID:	376888
PubChem CID:	134222918
Reduced:	CClOP2H5 (1)
Stoich.:	ABCD2E5 (1)
Weight, g/mol:	883.062394
ΔH_f, kcal/mol:	-46.35
Dipole, Da:	5.49
IP(EA), eV:	-9.53(0.44)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[6-[[1-[3-[(2,2-dichloroacetyl)amino]propanoyloxy]-3-(2,2-dichloroacetyl)oxy-2-[(2,2-dichloroacetyl)oxymethyl]propan-2-yl]amino]-6-oxohexyl]-triphenylphosphanium

Drug info:

PubChemData

Smile

C(PP=O)Cl

DOS

IR

Vibrations