Geometry & MOs

Info

ID:	259411
PubChem CID:	103165488
Reduced:	ClO2C18H21 (1)
Stoich.:	AB2C18D21 (1)
Weight, g/mol:	391.98096
ΔH_f, kcal/mol:	-68.49
Dipole, Da:	1.69
IP(EA), eV:	-9.02(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,5-dibromo-4-methylphenyl)-2-(3-ethoxycyclobutyl)ethanol

Drug info:

PubChemData

Smile

CCOC1CC(C1)CC(C2=CC=C(C3=CC=CC=C32)Cl)O

DOS

IR

Vibrations