Geometry & MOs

Info

ID:	265887
PubChem CID:	103555996
Reduced:	FO2C14H17 (1)
Stoich.:	AB2C14D17 (1)
Weight, g/mol:	301.99761
ΔH_f, kcal/mol:	-111.55
Dipole, Da:	3.07
IP(EA), eV:	-9.73(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)CC2(CCC2)OC)F

DOS

IR

Vibrations