Geometry & MOs

Info

ID:	291073
PubChem CID:	111677857
Reduced:	FIO2N5C23H33 (1)
Stoich.:	ABC2D5E23F33 (1)
Weight, g/mol:	429.254003
ΔH_f, kcal/mol:	-68.72
Dipole, Da:	6.35
IP(EA), eV:	-8.35(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCNC(=NCC1=CN=C(C=C1)N2CCOC(C2)C)NCC(C)OC3=CC=C(C=C3)F.I

DOS

IR

Vibrations