Geometry & MOs

Info

ID:	266393
PubChem CID:	103564344
Reduced:	ClO2C13H17 (1)
Stoich.:	AB2C13D17 (1)
Weight, g/mol:	218.167065
ΔH_f, kcal/mol:	-87.38
Dipole, Da:	4.17
IP(EA), eV:	-8.71(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-1-[(2,4,6-trimethylphenyl)methyl]cyclobutan-1-ol

Drug info:

PubChemData

Smile

CC1CC(C1)(CC2=C(C=CC(=C2)Cl)OC)O

DOS

IR

Vibrations