Geometry & MOs

Info

ID:

226530

PubChem CID:

87457777

Reduced:

BrON5F6C28H32 (1)

Stoich.:

ABC5D6E28F32 (1)

Weight, g/mol:

472.058374

ΔHf, kcal/mol:

-284.2

Dipole, Da:

3.59

IP(EA), eV:

 -8.65(-1.26)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

6-chloro-4-[[5,5-dimethyl-2,4-dioxo-3-[4-(trifluoromethylsulfanyl)phenyl]imidazolidin-1-yl]methyl]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CCN(CC1CCCC1)C2=C(N(C(C=C2)OC)CC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)CNC4=NC=C(C=N4)Br

DOS

IR

Vibrations