Geometry & MOs

Info

ID:	280521
PubChem CID:	103849730
Reduced:	FO2C17H19 (1)
Stoich.:	AB2C17D19 (1)
Weight, g/mol:	284.144616
ΔH_f, kcal/mol:	-110.59
Dipole, Da:	2.14
IP(EA), eV:	-8.57(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-tert-butylsulfonylethoxy)-4-propan-2-ylbenzene

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)OCC(C2=CC=CC=C2F)O)C)C

DOS

IR

Vibrations