Geometry & MOs

Info

ID:	17705
PubChem CID:	513587
Reduced:	PN4O10C14H23 (1)
Stoich.:	AB4C10D14E23 (1)
Weight, g/mol:	438.11518
ΔH_f, kcal/mol:	-471.64
Dipole, Da:	4.56
IP(EA), eV:	-10.16(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[[(2R,5R)-5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-ethoxyphosphoryl]amino]propanoate

Drug info:

PubChemData

Smile

CCOP(=O)(NC(C)C(=O)OC)OC[C@@H]1C(C([C@@H](O1)N2C(=O)NC(=O)C=N2)O)O

DOS

IR

Vibrations