Geometry & MOs

Info

ID:	283685
PubChem CID:	103998555
Reduced:	ON2C17H24 (1)
Stoich.:	AB2C17D24 (1)
Weight, g/mol:	281.152812
ΔH_f, kcal/mol:	-37.29
Dipole, Da:	5.54
IP(EA), eV:	-9.26(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dihydro-1H-isoindol-5-yl-[2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CN(CC1CCCCC1)C(=O)C2=CC3=C(CNC3)C=C2

DOS

IR

Vibrations