Geometry & MOs

Info

ID:	341398
PubChem CID:	127264091
Reduced:	F2N2O2C13H16 (1)
Stoich.:	A2B2C2D13E16 (1)
Weight, g/mol:	304.110919
ΔH_f, kcal/mol:	-154.84
Dipole, Da:	3.64
IP(EA), eV:	-8.91(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(2,3-dihydro-1-benzofuran-6-yl)ethyl]piperazine;dihydrochloride

Drug info:

PubChemData

Smile

CC(C1=CC2=C(C=C1)OC(O2)(F)F)N3CCNCC3

DOS

IR

Vibrations