Geometry & MOs

Info

ID:	266013
PubChem CID:	103557596
Reduced:	ClO2C17H19 (1)
Stoich.:	AB2C17D19 (1)
Weight, g/mol:	304.01326
ΔH_f, kcal/mol:	-62.4
Dipole, Da:	2.67
IP(EA), eV:	-9.14(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromo-4-methylthiophen-2-yl)-2-(1-methoxycyclobutyl)ethanol

Drug info:

PubChemData

Smile

COC1(CCC1)CC(C2=CC=C(C3=CC=CC=C32)Cl)O

DOS

IR

Vibrations