Geometry & MOs

Info

ID:	259461
PubChem CID:	103166018
Reduced:	ClOC15H21 (1)
Stoich.:	ABC15D21 (1)
Weight, g/mol:	291.96881
ΔH_f, kcal/mol:	-54.77
Dipole, Da:	1.6
IP(EA), eV:	-9.2(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1-bromo-2-cyclobutylethyl)-2-chloro-3-methylthiophene

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1OC)C)C(CC2CCC2)Cl

DOS

IR

Vibrations