Geometry & MOs

Info

ID:	410372
PubChem CID:	135083167
Reduced:	NOC12H15 (1)
Stoich.:	ABC12D15 (1)
Weight, g/mol:	235.086938
ΔH_f, kcal/mol:	21.12
Dipole, Da:	4.07
IP(EA), eV:	-9.4(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1S,2Z)-2-[(6-aminopurin-9-yl)methylidene]-1-fluorocyclopropyl]methanol

Drug info:

PubChemData

Smile

CC(C)(C)N=C([CH+]C1=CC=CC=C1)[O-]

DOS

IR

Vibrations