Geometry & MOs

Info

ID:	179450
PubChem CID:	76485091
Reduced:	O5C21H36 (1)
Stoich.:	A5B21C36 (1)
Weight, g/mol:	306.144038
ΔH_f, kcal/mol:	-273.26
Dipole, Da:	5.09
IP(EA), eV:	-9.82(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(6-aminopurin-9-yl)-3-(prop-1-en-2-ylamino)oxyoxolan-2-yl]methanol

Drug info:

PubChemData

Smile

CCCCCCC=CC1CCC2C1CC(O2)CCCC(C(=O)OC)(O)O

DOS

IR

Vibrations