Geometry & MOs

Info

ID:	289589
PubChem CID:	104359889
Reduced:	BrFNOH15C16 (1)
Stoich.:	ABCDE15F16 (1)
Weight, g/mol:	340.07864
ΔH_f, kcal/mol:	-46.93
Dipole, Da:	5.28
IP(EA), eV:	-8.38(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-bromo-2,3-dihydro-1-benzofuran-7-yl)methyl]-2-morpholin-4-ylethanamine

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)F)NCC2=CC(=CC3=C2OCC3)Br

DOS

IR

Vibrations