Geometry & MOs

Info

ID:	289634
PubChem CID:	104362010
Reduced:	ClNO2C15H16 (1)
Stoich.:	ABC2D15E16 (1)
Weight, g/mol:	344.04119
ΔH_f, kcal/mol:	-55.45
Dipole, Da:	5.44
IP(EA), eV:	-8.82(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-bromo-2,3-dihydro-1-benzofuran-7-yl)methyl]-1,3-dihydroinden-2-ol

Drug info:

PubChemData

Smile

CC(C1=CN(C=C1)CC2=CC(=CC3=C2OCC3)Cl)O

DOS

IR

Vibrations