Geometry & MOs

Info

ID:	218493
PubChem CID:	85089531
Reduced:	S2F3N3O5H14C18 (1)
Stoich.:	A2B3C3D5E14F18 (1)
Weight, g/mol:	473.059263
ΔH_f, kcal/mol:	-248.46
Dipole, Da:	7.55
IP(EA), eV:	-9.86(-2.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-acetyloxy-5-(6-aminopurin-9-yl)-2-(1,3,2-dithiaphospholan-2-yloxymethyl)oxolan-3-yl] acetate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC(C(=O)N=C1C(F)(F)F)C2=CSC(=N2)CS(=O)(=O)C3=CC=CC=N3

DOS

IR

Vibrations