Geometry & MOs

Info

ID:	220416
PubChem CID:	85189536
Reduced:	N5O6C15H23 (1)
Stoich.:	A5B6C15D23 (1)
Weight, g/mol:	369.143704
ΔH_f, kcal/mol:	-176.64
Dipole, Da:	4.12
IP(EA), eV:	-9.52(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-(6-aminopurin-9-yl)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-ol

Drug info:

PubChemData

Smile

CC(C)(C)N(C1=NC2=C(N1C3C(C(C(O3)CO)O)O)N=CN=C2OC)O

DOS

IR

Vibrations