Geometry & MOs

Info

ID:	291096
PubChem CID:	111677885
Reduced:	FIN3O4C21H29 (1)
Stoich.:	ABC3D4E21F29 (1)
Weight, g/mol:	405.206385
ΔH_f, kcal/mol:	-153.75
Dipole, Da:	3.61
IP(EA), eV:	-8.71(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-fluorophenoxy)propyl]-2-methyl-3-[(2,4,6-trimethoxyphenyl)methyl]guanidine

Drug info:

PubChemData

Smile

CC(CNC(=NC)NCC1=C(C=C(C=C1OC)OC)OC)OC2=CC=C(C=C2)F.I

DOS

IR

Vibrations