Geometry & MOs

Info

ID:	159362
PubChem CID:	57269687
Reduced:	PN2O4C15H15 (1)
Stoich.:	AB2C4D15E15 (1)
Weight, g/mol:	341.158685
ΔH_f, kcal/mol:	-168.53
Dipole, Da:	3.05
IP(EA), eV:	-8.22(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-5-[azido-[2-(1,2,2,2-tetrahydroxyethyl)spiro[2.5]octan-1-yl]methyl]oxolan-2-one

Drug info:

PubChemData

Smile

C1C(=CC2=CC=C(C=C2)OP(=O)(O)O)C3=C(N1)C(=CC=C3)N

DOS

IR

Vibrations