Geometry & MOs

Info

ID:	215204
PubChem CID:	85084359
Reduced:	N6O6C43H58 (1)
Stoich.:	A6B6C43D58 (1)
Weight, g/mol:	755.222742
ΔH_f, kcal/mol:	-232.55
Dipole, Da:	5.57
IP(EA), eV:	-9.26(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[4-acetyloxy-5-(6-benzamidopurin-9-yl)-3-benzoyloxyoxolan-2-yl]-2-benzoyloxyethyl] benzoate

Drug info:

PubChemData

Smile

CCC(C)C1C(=O)N2CCCCC2C(=O)N3CCCCC3C(=O)N(C(C(=O)N4CCCC4C(=O)NC(C(=O)N1C)CC5=CC=CC=C5)CC6=CC=CC=C6)C

DOS

IR

Vibrations