Geometry & MOs

Info

ID:	291150
PubChem CID:	111678047
Reduced:	FISN3O3C16H25 (1)
Stoich.:	ABCD3E3F16G25 (1)
Weight, g/mol:	357.152241
ΔH_f, kcal/mol:	-147.65
Dipole, Da:	7.4
IP(EA), eV:	-9.35(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1,1-dioxothiolan-3-yl)methyl]-3-[2-(4-fluorophenoxy)propyl]-2-methylguanidine

Drug info:

PubChemData

Smile

CC(CNC(=NC)NCC1CCS(=O)(=O)C1)OC2=CC=C(C=C2)F.I

DOS

IR

Vibrations