Geometry & MOs

Info

ID:	291116
PubChem CID:	111677905
Reduced:	FIO2N4C19H24 (1)
Stoich.:	ABC2D4E19F24 (1)
Weight, g/mol:	358.180504
ΔH_f, kcal/mol:	-72.32
Dipole, Da:	7.72
IP(EA), eV:	-9.06(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[[N-[2-(4-fluorophenoxy)propyl]-N'-methylcarbamimidoyl]amino]methyl]benzamide

Drug info:

PubChemData

Smile

CC(CNC(=NC)NCC1=CC=C(C=C1)C(=O)N)OC2=CC=C(C=C2)F.I

DOS

IR

Vibrations