Geometry & MOs

Info

ID:	265997
PubChem CID:	103557546
Reduced:	Cl2O2C13H16 (1)
Stoich.:	A2B2C13D16 (1)
Weight, g/mol:	328.06741
ΔH_f, kcal/mol:	-86.62
Dipole, Da:	3.75
IP(EA), eV:	-9.43(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromo-2-ethoxyphenyl)-2-(1-methoxycyclobutyl)ethanol

Drug info:

PubChemData

Smile

COC1(CCC1)CC(C2=CC(=C(C=C2)Cl)Cl)O

DOS

IR

Vibrations