Geometry & MOs

Info

ID:	425431
PubChem CID:	135126307
Reduced:	IF2O2S2N3C11H14 (1)
Stoich.:	AB2C2D2E3F11G14 (1)
Weight, g/mol:	350.00999
ΔH_f, kcal/mol:	-127.82
Dipole, Da:	7.2
IP(EA), eV:	-8.55(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1R)-1-amino-1-(5-bromo-2-fluorophenyl)ethyl]-N-methylcyclopropane-1-sulfonamide

Drug info:

PubChemData

Smile

CC(CS(=O)(=O)NC)(C1=C(C(=CC(=C1)I)F)F)NC(=S)N

DOS

IR

Vibrations