Geometry & MOs

Info

ID:	291065
PubChem CID:	111677847
Reduced:	FIO3N4C21H30 (1)
Stoich.:	ABC3D4E21F30 (1)
Weight, g/mol:	404.222369
ΔH_f, kcal/mol:	-110.62
Dipole, Da:	3.26
IP(EA), eV:	-9.03(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-3-[2-(4-fluorophenoxy)propyl]-2-[[2-(2-methoxyethoxy)pyridin-3-yl]methyl]guanidine

Drug info:

PubChemData

Smile

CCNC(=NCC1=C(N=CC=C1)OCCOC)NCC(C)OC2=CC=C(C=C2)F.I

DOS

IR

Vibrations