Geometry & MOs

Info

ID:	245857
PubChem CID:	103024636
Reduced:	SO2C12H18 (1)
Stoich.:	AB2C12D18 (1)
Weight, g/mol:	250.156895
ΔH_f, kcal/mol:	-82.75
Dipole, Da:	1.22
IP(EA), eV:	-9.25(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-ethoxyphenyl)-4-methoxy-4-methylpentan-1-one

Drug info:

PubChemData

Smile

CC(C)(CCC(=O)CC1=CC=CS1)OC

DOS

IR

Vibrations