Geometry & MOs

Info

ID:	221635
PubChem CID:	85285793
Reduced:	BrSO2N4C28H33 (1)
Stoich.:	ABC2D4E28F33 (1)
Weight, g/mol:	569.994615
ΔH_f, kcal/mol:	26.45
Dipole, Da:	4.39
IP(EA), eV:	-8.25(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodec-1-enylsulfinylbenzene

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NN=CCCCC(CCCC=NN(C2=CC=CC=C2)C3=CC=CC=C3)Br

DOS

IR

Vibrations