Geometry & MOs

Info

ID:	230488
PubChem CID:	87571043
Reduced:	BrFSN2O3C22H26 (1)
Stoich.:	ABCD2E3F22G26 (1)
Weight, g/mol:	594.62324
ΔH_f, kcal/mol:	-125.84
Dipole, Da:	4.86
IP(EA), eV:	-8.66(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9,10-dioctyltetracosan-9-ylphosphane

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)Br)N(CC/C(=N/S(=O)C(C)(C)C)/C2=CC=C(C=C2)F)C(=O)O

DOS

IR

Vibrations