Geometry & MOs

Info

ID:	289642
PubChem CID:	104362563
Reduced:	BrNO2C15H20 (1)
Stoich.:	ABC2D15E20 (1)
Weight, g/mol:	476.83977
ΔH_f, kcal/mol:	-77.95
Dipole, Da:	5.03
IP(EA), eV:	-8.84(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-bromo-2,3-dihydro-1-benzofuran-7-yl)-1-(3,5-dibromopyridin-2-yl)ethanol

Drug info:

PubChemData

Smile

C1CC(CCNC1)(CC2=CC(=CC3=C2OCC3)Br)O

DOS

IR

Vibrations