Geometry & MOs

Info

ID:	28805
PubChem CID:	829751
Reduced:	NO2C20H23 (1)
Stoich.:	AB2C20D23 (1)
Weight, g/mol:	279.125929
ΔH_f, kcal/mol:	-47.5
Dipole, Da:	4.67
IP(EA), eV:	-8.7(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzo[e][1]benzofuran-1-yl-1-pyrrolidin-1-ylethanone

Drug info:

PubChemData

Smile

CCCN(CCC)C(=O)CC1=COC2=C1C3=CC=CC=C3C=C2

DOS

IR

Vibrations