Geometry & MOs

Info

ID:	266385
PubChem CID:	103564096
Reduced:	ClOC13H17 (1)
Stoich.:	ABC13D17 (1)
Weight, g/mol:	254.107358
ΔH_f, kcal/mol:	-48.98
Dipole, Da:	3.38
IP(EA), eV:	-9.5(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chloro-2-methoxyphenyl)-3-propan-2-ylcyclobutan-1-ol

Drug info:

PubChemData

Smile

CC(C)C1CC(C1)(C2=CC(=CC=C2)Cl)O

DOS

IR

Vibrations