Geometry & MOs

Info

ID:	273704
PubChem CID:	103771845
Reduced:	N2O2C11H24 (1)
Stoich.:	A2B2C11D24 (1)
Weight, g/mol:	227.098
ΔH_f, kcal/mol:	-144.27
Dipole, Da:	4.3
IP(EA), eV:	-9.57(1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]hexan-2-one

Drug info:

PubChemData

Smile

CCC(C)(CCO)NC(=O)NC(C)(C)C

DOS

IR

Vibrations