Geometry & MOs

Info

ID:	311275
PubChem CID:	126590128
Reduced:	ON4C13H22 (1)
Stoich.:	AB4C13D22 (1)
Weight, g/mol:	226.102751
ΔH_f, kcal/mol:	-28.46
Dipole, Da:	3.81
IP(EA), eV:	-9.0(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[(R)-ethylsulfinyl]propoxy]-3-methylbenzene

Drug info:

PubChemData

Smile

CC1=CN(C=N1)CC(=O)NCCCN2CCCC2

DOS

IR

Vibrations