Geometry & MOs

Info

ID:	423352
PubChem CID:	135119349
Reduced:	FNO3C24H26 (1)
Stoich.:	ABC3D24E26 (1)
Weight, g/mol:	346.179361
ΔH_f, kcal/mol:	-118.09
Dipole, Da:	4.83
IP(EA), eV:	-9.02(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1H-indol-7-yl-(2-methylspiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]-1'-yl)methanone

Drug info:

PubChemData

Smile

COC1=CC=CC2=C1C3(CCN(CC3)C(=O)C4(CC4)C5=CC=CC=C5F)OCC2

DOS

IR

Vibrations