Geometry & MOs

Info

ID:	291110
PubChem CID:	111677899
Reduced:	FIO2N4C18H28 (1)
Stoich.:	ABC2D4E18F28 (1)
Weight, g/mol:	350.211804
ΔH_f, kcal/mol:	-93.96
Dipole, Da:	3.21
IP(EA), eV:	-9.17(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(CNC(=NC)NCCCC(=O)NC1CC1)OC2=CC=C(C=C2)F.I

DOS

IR

Vibrations