Geometry & MOs

Info

ID:	281281
PubChem CID:	103913643
Reduced:	OC13H18 (1)
Stoich.:	AB13C18 (1)
Weight, g/mol:	275.98196
ΔH_f, kcal/mol:	-49.02
Dipole, Da:	1.0
IP(EA), eV:	-8.51(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-bromo-3-methoxy-2-(2-methylsulfanylethoxy)benzene

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)OC2CCCC2)C

DOS

IR

Vibrations