Geometry & MOs

Info

ID:	189912
PubChem CID:	77922575
Reduced:	SF3O3N4C19H31 (1)
Stoich.:	AB3C3D4E19F31 (1)
Weight, g/mol:	556.314852
ΔH_f, kcal/mol:	-275.59
Dipole, Da:	7.32
IP(EA), eV:	-9.67(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 5-[(4-butoxyphenyl)methyl]-4-(2,3-dihydroxypropyl)-3-(2-oxo-2-phenylmethoxyethyl)imidazolidine-1-carboxylate

Drug info:

PubChemData

Smile

CCC(CCC(CC1=CC(=C(C=C1F)F)F)N)N(CC(C)C)C(=O)CNS(=O)(=O)N

DOS

IR

Vibrations