Geometry & MOs

Info

ID:	291168
PubChem CID:	111678077
Reduced:	FIO2N4C16H26 (1)
Stoich.:	ABC2D4E16F26 (1)
Weight, g/mol:	324.196154
ΔH_f, kcal/mol:	-111.0
Dipole, Da:	6.1
IP(EA), eV:	-8.7(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[N-[2-(4-fluorophenoxy)propyl]-N'-methylcarbamimidoyl]amino]-N-propylacetamide

Drug info:

PubChemData

Smile

CCCNC(=O)CNC(=NC)NCC(C)OC1=CC=C(C=C1)F.I

DOS

IR

Vibrations