Geometry & MOs

Info

ID:	265895
PubChem CID:	103556008
Reduced:	ClFO2C14H16 (1)
Stoich.:	ABC2D14E16 (1)
Weight, g/mol:	238.102751
ΔH_f, kcal/mol:	-120.45
Dipole, Da:	3.14
IP(EA), eV:	-9.49(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,5-dimethylthiophen-2-yl)-2-(1-methoxycyclobutyl)ethanone

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)Cl)C(=O)CC2(CCC2)OC

DOS

IR

Vibrations