Geometry & MOs

Info

ID:	54834
PubChem CID:	17389374
Reduced:	SO2N5H13C19 (1)
Stoich.:	AB2C5D13E19 (1)
Weight, g/mol:	447.930105
ΔH_f, kcal/mol:	85.08
Dipole, Da:	10.93
IP(EA), eV:	-7.98(-2.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bis(chloromethyl)-bis[(4-chlorophenoxy)methyl]phosphanium;chloride

Drug info:

PubChemData

Smile

C1=CC=C2C=[N+](C=CC2=C1)C3=C(SC(=N3)[O-])/C=N/NC(=O)C4=CN=CC=C4

DOS

IR

Vibrations