Geometry & MOs

Info

ID:	259424
PubChem CID:	103165643
Reduced:	ClNO2C17H22 (1)
Stoich.:	ABC2D17E22 (1)
Weight, g/mol:	228.073949
ΔH_f, kcal/mol:	-87.35
Dipole, Da:	2.62
IP(EA), eV:	-8.78(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-chloro-2-cyclobutylethyl)-2,5-dimethylthiophene

Drug info:

PubChemData

Smile

CCOC1CC(C1)CC(C2=CC3=C(C=C2)N(C(=O)C3)C)Cl

DOS

IR

Vibrations