Geometry & MOs

Info

ID:	16353
PubChem CID:	465209
Reduced:	PN5O9C26H26 (1)
Stoich.:	AB5C9D26E26 (1)
Weight, g/mol:	583.146814
ΔH_f, kcal/mol:	-295.49
Dipole, Da:	5.61
IP(EA), eV:	-9.53(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl diphenacyl phosphate

Drug info:

PubChemData

Smile

CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COP(=O)(OCC(=O)C3=CC=CC=C3)OCC(=O)C4=CC=CC=C4)N=[N+]=[N-]

DOS

IR

Vibrations