Geometry & MOs

Info

ID:	339166
PubChem CID:	127260545
Reduced:	O3N6C17H26 (1)
Stoich.:	A3B6C17D26 (1)
Weight, g/mol:	390.237939
ΔH_f, kcal/mol:	-73.18
Dipole, Da:	5.55
IP(EA), eV:	-8.61(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]-N,N-bis(2-methylpropyl)methanimidamide

Drug info:

PubChemData

Smile

CC(C)N(/C=N/C1=C2C(=NC=N1)N(C=N2)[C@H]3C[C@@H]([C@H](O3)CO)O)C(C)C

DOS

IR

Vibrations