Geometry & MOs

Info

ID:	59665
PubChem CID:	24892596
Reduced:	SO4N5C23H23 (1)
Stoich.:	AB4C5D23E23 (1)
Weight, g/mol:	447.08951
ΔH_f, kcal/mol:	-98.33
Dipole, Da:	3.19
IP(EA), eV:	-8.74(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(3-amino-3-carboxypropyl)-[[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl]-methylselanium

Drug info:

PubChemData

Smile

CC(=O)NC1=CC(=CC=C1)NC(=O)CSC2=NC3=C(C(=O)N2CCOC)NC4=CC=CC=C43

DOS

IR

Vibrations