Geometry & MOs

Info

ID:	88653
PubChem CID:	49955926
Reduced:	ClNOC11H15 (2)
Stoich.:	ABCD11E15 (2)
Weight, g/mol:	392.062525
ΔH_f, kcal/mol:	115.14
Dipole, Da:	14.32
IP(EA), eV:	-8.2(-7.3)
Spin(S_z, S²):	None, None
Charge, e:	-2

Chem-info

IUPAC name:

N-[[5-(3-chloro-4-fluorophenyl)furan-2-yl]methyl]-1-piperidin-4-ylmethanamine;dichloride

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1OCC2=CC=CC=C2)CNCC3CCNCC3.[Cl-].[Cl-]

DOS

IR

Vibrations