Geometry & MOs

Info

ID:	269544
PubChem CID:	103617919
Reduced:	ClSN2C9H13 (1)
Stoich.:	ABC2D9E13 (1)
Weight, g/mol:	281.052193
ΔH_f, kcal/mol:	24.35
Dipole, Da:	2.99
IP(EA), eV:	-8.93(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-1-(5-fluoro-2-hydroxyphenyl)ethanone

Drug info:

PubChemData

Smile

CCCCCSC1=NN=C(C=C1)Cl

DOS

IR

Vibrations