Geometry & MOs

Info

ID:	262580
PubChem CID:	103302065
Reduced:	OSN2C5H9 (2)
Stoich.:	ABC2D5E9 (2)
Weight, g/mol:	334.95912
ΔH_f, kcal/mol:	-40.48
Dipole, Da:	6.89
IP(EA), eV:	-8.58(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-bromothiophen-2-yl)-N-methyl-1-(2,4,5-trifluorophenyl)methanamine

Drug info:

PubChemData

Smile

CCSCC(C)NS(=O)(=O)C1=C(C=CC=N1)NN

DOS

IR

Vibrations