Geometry & MOs

Info

ID:	320095
PubChem CID:	126658187
Reduced:	FN3C20H22 (1)
Stoich.:	AB3C20D22 (1)
Weight, g/mol:	222.104465
ΔH_f, kcal/mol:	6.38
Dipole, Da:	0.8
IP(EA), eV:	-8.47(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-methylspiro[cyclopropane-1,9'-xanthene]

Drug info:

PubChemData

Smile

CC(C)CNCC1=CN=C(C2=C1C=CC(=C2)C3=CC(=CC=C3)F)N

DOS

IR

Vibrations