Geometry & MOs

Info

ID:	339172
PubChem CID:	127260551
Reduced:	O2N3C6H8 (2)
Stoich.:	A2B3C6D8 (2)
Weight, g/mol:	381.176067
ΔH_f, kcal/mol:	-117.48
Dipole, Da:	3.67
IP(EA), eV:	-9.38(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-5-[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methylamino]pentanoic acid

Drug info:

PubChemData

Smile

CC(=O)N1[C@@H]([C@H]([C@H]([C@@H]1N2C=NC3=C(N=CN=C32)N)O)O)CO

DOS

IR

Vibrations