Geometry & MOs

Info

ID:	285508
PubChem CID:	104109947
Reduced:	ClNOC14H20 (1)
Stoich.:	ABCD14E20 (1)
Weight, g/mol:	271.11392
ΔH_f, kcal/mol:	-54.41
Dipole, Da:	1.83
IP(EA), eV:	-8.75(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]pentan-2-amine

Drug info:

PubChemData

Smile

CC(CC(C)Cl)NCC1CC2=CC=CC=C2O1

DOS

IR

Vibrations