Geometry & MOs

Info

ID:	398510
PubChem CID:	135033569
Reduced:	FNPH22C26 (1)
Stoich.:	ABCD22E26 (1)
Weight, g/mol:	472.278876
ΔH_f, kcal/mol:	78.96
Dipole, Da:	10.73
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.920409
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-1-[(2R,4R,5R)-4-triethylsilyloxy-5-(triethylsilyloxymethyl)oxolan-2-yl]-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

C1CC1C2=NC=C(C(=C2)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)F

DOS

IR

Vibrations