Geometry & MOs

Info

ID:	433958
PubChem CID:	135174105
Reduced:	BrON2C19H23 (1)
Stoich.:	ABC2D19E23 (1)
Weight, g/mol:	384.02402
ΔH_f, kcal/mol:	1.48
Dipole, Da:	1.39
IP(EA), eV:	-8.85(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(azetidin-3-yl)-N-[[5-[(2-bromo-4-chlorophenoxy)methyl]furan-2-yl]methyl]methanamine

Drug info:

PubChemData

Smile

C1CNCCC1NCC2=CC=C(C=C2)OCC3=CC=CC=C3Br

DOS

IR

Vibrations