Geometry & MOs

Info

ID:	290843
PubChem CID:	111362143
Reduced:	F2N5C21H23 (1)
Stoich.:	A2B5C21D23 (1)
Weight, g/mol:	452.08732
ΔH_f, kcal/mol:	1.45
Dipole, Da:	6.79
IP(EA), eV:	-9.07(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2-fluorophenyl)ethyl]-3-(1H-indol-2-ylmethyl)-2-methylguanidine;hydroiodide

Drug info:

PubChemData

Smile

CC1=NC=CN1C2=C(C=C(C=C2)CNC(=NC)NCCC3=CC=CC=C3F)F

DOS

IR

Vibrations