Geometry & MOs

Info

ID:	259286
PubChem CID:	103162414
Reduced:	ClO4C16H21 (1)
Stoich.:	AB4C16D21 (1)
Weight, g/mol:	247.982942
ΔH_f, kcal/mol:	-143.95
Dipole, Da:	5.46
IP(EA), eV:	-8.72(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclobutyl-1-(2,5-dichlorothiophen-3-yl)ethanone

Drug info:

PubChemData

Smile

CCOC1CC(C1)CC(=O)C2=CC(=C(C=C2Cl)OC)OC

DOS

IR

Vibrations