Geometry & MOs

Info

ID:	156803
PubChem CID:	56385693
Reduced:	SN2F3O4H15C18 (1)
Stoich.:	AB2C3D4E15F18 (1)
Weight, g/mol:	447.140591
ΔH_f, kcal/mol:	-274.81
Dipole, Da:	4.27
IP(EA), eV:	-9.56(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-5-methyl-5-[4-(trifluoromethoxy)phenyl]imidazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C(=O)CN2C(=O)C(NC2=O)(C)C3=CC=C(C=C3)OC(F)(F)F

DOS

IR

Vibrations