Geometry & MOs

Info

ID:	207782
PubChem CID:	80449128
Reduced:	FNSO2C14H22 (1)
Stoich.:	ABCD2E14F22 (1)
Weight, g/mol:	317.0449
ΔH_f, kcal/mol:	-132.79
Dipole, Da:	5.44
IP(EA), eV:	-9.09(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromophenyl)sulfinyl-N-ethyl-3-methylbutan-2-amine

Drug info:

PubChemData

Smile

CCCNC(CS(=O)(=O)C1=CC=C(C=C1)F)C(C)C

DOS

IR

Vibrations