Geometry & MOs

Info

ID:	439191
PubChem CID:	135228956
Reduced:	ISN2C10H15 (1)
Stoich.:	ABC2D10E15 (1)
Weight, g/mol:	274.110613
ΔH_f, kcal/mol:	64.05
Dipole, Da:	5.06
IP(EA), eV:	-8.74(-2.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5R)-5H-imidazo[5,1-a]isoindol-5-yl]-1-phenylethanone

Drug info:

PubChemData

Smile

CN1CCN=C1CCCCC#CSI

DOS

IR

Vibrations