Geometry & MOs

Info

ID:	437854
PubChem CID:	135227193
Reduced:	BrNOSF2C16H16 (1)
Stoich.:	ABCDE2F16G16 (1)
Weight, g/mol:	469.83472
ΔH_f, kcal/mol:	-89.76
Dipole, Da:	4.74
IP(EA), eV:	-9.41(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2,3-diiodo-4-(4-phosphanylphenyl)phenyl]phosphane

Drug info:

PubChemData

Smile

C1CC(CCC1OC2=C(C=C(C=C2)SC3(CC3)C#N)Br)(F)F

DOS

IR

Vibrations