Geometry & MOs

Info

ID:	324024
PubChem CID:	126676780
Reduced:	FN6H11C18 (1)
Stoich.:	AB6C11D18 (1)
Weight, g/mol:	581.132994
ΔH_f, kcal/mol:	134.82
Dipole, Da:	4.3
IP(EA), eV:	-9.11(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl (2S)-2-[[[(2R,3R,4S,5R)-4-chloro-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy-naphthalen-1-yloxyphosphoryl]amino]propanoate

Drug info:

PubChemData

Smile

C1=CC(=NC(=C1)F)C2=NN3C=CC=C3C(=N2)N4C=CC5=C4C=CN=C5

DOS

IR

Vibrations