Geometry & MOs

Info

ID:	195500
PubChem CID:	78695013
Reduced:	SF2N2O2H16C19 (1)
Stoich.:	AB2C2D2E16F19 (1)
Weight, g/mol:	333.132471
ΔH_f, kcal/mol:	-111.36
Dipole, Da:	3.09
IP(EA), eV:	-8.99(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(4-methylanilino)-1-oxopropan-2-yl] 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetate

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1N2C(=O)C(=CC3=CC=CC=C3OC(F)F)NC2=S

DOS

IR

Vibrations