Geometry & MOs

Info

ID:	311912
PubChem CID:	126599388
Reduced:	NC13H25 (1)
Stoich.:	AB13C25 (1)
Weight, g/mol:	754.228292
ΔH_f, kcal/mol:	-43.7
Dipole, Da:	1.38
IP(EA), eV:	-8.37(2.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-bis(phenylmethoxy)phosphoryl-2-[[(2R,3S,4R,5R)-5-(2-chloro-6-imidazol-1-ylpurin-9-yl)-3-(2-hydroxypropan-2-yloxy)-4-methyloxolan-2-yl]methoxy]acetate

Drug info:

PubChemData

Smile

CCC(C)N1CCC2CCCCC2C1

DOS

IR

Vibrations