Geometry & MOs

Info

ID:	266392
PubChem CID:	103564343
Reduced:	BrFOC12H14 (1)
Stoich.:	ABCD12E14 (1)
Weight, g/mol:	240.091708
ΔH_f, kcal/mol:	-82.78
Dipole, Da:	3.01
IP(EA), eV:	-9.53(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5-chloro-2-methoxyphenyl)methyl]-3-methylcyclobutan-1-ol

Drug info:

PubChemData

Smile

CC1CC(C1)(CC2=C(C=C(C=C2)Br)F)O

DOS

IR

Vibrations