Geometry & MOs

Info

ID:	439196
PubChem CID:	135228961
Reduced:	NC22H37 (1)
Stoich.:	AB22C37 (1)
Weight, g/mol:	323.14339
ΔH_f, kcal/mol:	-17.56
Dipole, Da:	0.69
IP(EA), eV:	-8.14(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-fluoro-3,5-dihydroimidazo[5,1-a]isoindol-5-yl)-1-[2-(methylamino)phenyl]ethanone

Drug info:

PubChemData

Smile

CC(CC(C)C1CCCCC1)/C=C(/C=C\C=C(C)C)\C(=C\N)\C

DOS

IR

Vibrations