Geometry & MOs

Info

ID:	265984
PubChem CID:	103557514
Reduced:	O5C16H24 (1)
Stoich.:	A5B16C24 (1)
Weight, g/mol:	262.19328
ΔH_f, kcal/mol:	-194.72
Dipole, Da:	0.82
IP(EA), eV:	-8.89(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-butan-2-ylphenyl)-2-(1-methoxycyclobutyl)ethanol

Drug info:

PubChemData

Smile

COC1=CC(=C(C(=C1)OC)C(CC2(CCC2)OC)O)OC

DOS

IR

Vibrations