Geometry & MOs

Info

ID:	265428
PubChem CID:	103520230
Reduced:	NSO2C10H15 (1)
Stoich.:	ABC2D10E15 (1)
Weight, g/mol:	267.012077
ΔH_f, kcal/mol:	-67.27
Dipole, Da:	2.85
IP(EA), eV:	-8.88(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorophenyl)-2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]ethanone

Drug info:

PubChemData

Smile

CCC(=O)CCCSC1=NC(=CO1)C

DOS

IR

Vibrations