Geometry & MOs

Info

ID:	345729
PubChem CID:	127270029
Reduced:	FNOC14H16 (1)
Stoich.:	ABCD14E16 (1)
Weight, g/mol:	397.155018
ΔH_f, kcal/mol:	-73.25
Dipole, Da:	3.74
IP(EA), eV:	-8.8(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-fluorospiro[2H-indole-3,1'-cyclobutane]-1-yl)-2-oxoethyl]-3,7-dimethylpurine-2,6-dione

Drug info:

PubChemData

Smile

CCC(=O)N1CC2(CCC2)C3=C1C=CC=C3F

DOS

IR

Vibrations