Geometry & MOs

Info

ID:	156948
PubChem CID:	56394950
Reduced:	O3N4C27H32 (1)
Stoich.:	A3B4C27D32 (1)
Weight, g/mol:	488.221226
ΔH_f, kcal/mol:	-42.53
Dipole, Da:	2.33
IP(EA), eV:	-8.67(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-oxo-N-[2-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]phenyl]fluorene-2-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCN1CCC2=CC=NC=C2)C3=CC=CC=C3NC(=O)COCCOC4=CC=CC=C4

DOS

IR

Vibrations