Geometry & MOs

Info

ID:	150818
PubChem CID:	53790514
Reduced:	OC4H8 (2)
Stoich.:	AB4C8 (2)
Weight, g/mol:	483.211784
ΔH_f, kcal/mol:	-103.0
Dipole, Da:	1.36
IP(EA), eV:	-8.66(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[9-[(2R,3R,4R,5R)-4-hydroxy-5-(hydroxymethyl)-3-[(1R,2R)-2-methoxycyclohexyl]oxyoxolan-2-yl]purin-6-yl]benzamide

Drug info:

PubChemData

Smile

C/C=C(\C)/OC.CC(=O)C

DOS

IR

Vibrations