Geometry & MOs

Info

ID:	44503
PubChem CID:	10503813
Reduced:	O2H14C15 (2)
Stoich.:	A2B14C15 (2)
Weight, g/mol:	452.193888
ΔH_f, kcal/mol:	-88.88
Dipole, Da:	1.64
IP(EA), eV:	-8.65(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[diethyl(phenyl)phosphaniumyl]-1,1-bis(4-methoxyphenyl)propane-1-thiolate

Drug info:

PubChemData

Smile

C1COC(OC1)C2=CC=CC=C2C3=CC=C(C4=CC=CC=C43)C5=CC=CC=C5C6OCCCO6

DOS

IR

Vibrations