Geometry & MOs

Info

ID:	226471
PubChem CID:	87457448
Reduced:	O2F3N3C22H26 (1)
Stoich.:	A2B3C3D22E26 (1)
Weight, g/mol:	490.97622
ΔH_f, kcal/mol:	-224.66
Dipole, Da:	5.03
IP(EA), eV:	-8.94(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2-bromopyridin-4-yl)methyl]-5-methyl-3-[4-(trifluoromethylsulfonyl)phenyl]imidazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1([C@@H]2CC3=CC4=C(C=C3C1(CCN2C(=O)C(F)(F)F)C)N=C(N4)[C@@H]5CCCO5)C

DOS

IR

Vibrations