Geometry & MOs

Info

ID:	290999
PubChem CID:	111677769
Reduced:	FION6C21H26 (1)
Stoich.:	ABCD6E21F26 (1)
Weight, g/mol:	396.207388
ΔH_f, kcal/mol:	13.31
Dipole, Da:	7.22
IP(EA), eV:	-8.95(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-fluorophenoxy)propyl]-2-methyl-3-[[6-(2-methylimidazol-1-yl)pyridin-3-yl]methyl]guanidine

Drug info:

PubChemData

Smile

CC1=NC=CN1C2=NC=C(C=C2)CNC(=NC)NCC(C)OC3=CC=C(C=C3)F.I

DOS

IR

Vibrations