Geometry & MOs

Info

ID:	343199
PubChem CID:	127266372
Reduced:	SO2F3N3C10H12 (1)
Stoich.:	AB2C3D3E10F12 (1)
Weight, g/mol:	324.02219
ΔH_f, kcal/mol:	-212.05
Dipole, Da:	5.15
IP(EA), eV:	-9.34(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3-bromo-1,2-oxazol-5-yl)methyl]-3-(2,5-dimethylpyridin-4-yl)urea

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)NC(=O)NCCS(=O)C(F)(F)F

DOS

IR

Vibrations