Geometry & MOs

Info

ID:	59278
PubChem CID:	24775871
Reduced:	OC20H32 (1)
Stoich.:	AB20C32 (1)
Weight, g/mol:	511.135581
ΔH_f, kcal/mol:	-52.14
Dipole, Da:	0.82
IP(EA), eV:	-8.41(1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2S)-2-[[[(1S,3R,4S,7R)-7-hydroxy-3-(5-methyl-2,4-dioxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-phenoxyphosphoryl]amino]propanoate

Drug info:

PubChemData

Smile

CC1=C(OC(=C1)C(C)(C)C)CC(C)(CCC=C(C)C)C=C

DOS

IR

Vibrations