Geometry & MOs

Info

ID:	61927
PubChem CID:	26715915
Reduced:	ClOF3N3C21H23 (1)
Stoich.:	ABC3D3E21F23 (1)
Weight, g/mol:	397.146013
ΔH_f, kcal/mol:	-165.54
Dipole, Da:	8.47
IP(EA), eV:	-8.77(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-2-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[(4-methylsulfanylphenyl)methyl]acetamide

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=CC=C1)N(C)C(=O)C2CCN(CC2)C3=C(C=C(C=N3)C(F)(F)F)Cl

DOS

IR

Vibrations