Geometry & MOs

Info

ID:	223549
PubChem CID:	85335218
Reduced:	N3O4C24H31 (1)
Stoich.:	A3B4C24D31 (1)
Weight, g/mol:	422.95795
ΔH_f, kcal/mol:	-141.01
Dipole, Da:	4.08
IP(EA), eV:	-8.57(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(6-amino-8-bromopurin-9-yl)oxy-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol

Drug info:

PubChemData

Smile

CCC1=C(C=CC(=C1)NC2CC(=O)N(C(=O)N2)CCOCCOCC3=CC=CC=C3)C

DOS

IR

Vibrations