Geometry & MOs

Info

ID:	257745
PubChem CID:	103148447
Reduced:	BrNOSF3C11H15 (1)
Stoich.:	ABCDE3F11G15 (1)
Weight, g/mol:	295.12177
ΔH_f, kcal/mol:	-179.22
Dipole, Da:	4.45
IP(EA), eV:	-9.24(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-ethylthiophen-2-yl)-N-methyl-4-(2,2,2-trifluoroethoxy)butan-2-amine

Drug info:

PubChemData

Smile

CNC(CCOCC(F)(F)F)CC1=CC=C(S1)Br

DOS

IR

Vibrations