Geometry & MOs

Info

ID:	318888
PubChem CID:	126653623
Reduced:	OH12C14 (2)
Stoich.:	AB12C14 (2)
Weight, g/mol:	282.209599
ΔH_f, kcal/mol:	70.2
Dipole, Da:	1.27
IP(EA), eV:	-8.3(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[6-[(dimethylamino)methyl]-1,5-dihydro-s-indacen-2-yl]-N,N-dimethylethanamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1C#CC2=CC=CC=C2)OC3CCCCO3)C#CC4=CC=CC=C4

DOS

IR

Vibrations