Geometry & MOs

Info

ID:	291026
PubChem CID:	111677801
Reduced:	FIO2N4C21H34 (1)
Stoich.:	ABC2D4E21F34 (1)
Weight, g/mol:	392.258754
ΔH_f, kcal/mol:	-123.46
Dipole, Da:	4.3
IP(EA), eV:	-8.7(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-2-[2-(4-fluorophenoxy)propyl]-3-[3-(2-oxopyrrolidin-1-yl)pentyl]guanidine

Drug info:

PubChemData

Smile

CCC(CCNC(=NCC(C)OC1=CC=C(C=C1)F)NCC)N2CCCC2=O.I

DOS

IR

Vibrations