Geometry & MOs

Info

ID:	60091
PubChem CID:	26675672
Reduced:	BrSN2O3H19C21 (1)
Stoich.:	ABC2D3E19F21 (1)
Weight, g/mol:	331.13322
ΔH_f, kcal/mol:	-38.35
Dipole, Da:	2.33
IP(EA), eV:	-8.89(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S)-3-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1CN(CCN1C(=O)COC2=C(C3=CC=CC=C3C=C2)Br)C(=O)C4=CC=CS4

DOS

IR

Vibrations