Geometry & MOs

Info

ID:	218574
PubChem CID:	85089636
Reduced:	NPO3H28C30 (1)
Stoich.:	ABC3D28E30 (1)
Weight, g/mol:	483.269299
ΔH_f, kcal/mol:	-71.27
Dipole, Da:	2.16
IP(EA), eV:	-8.04(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3,4-dihydroxy-5-(5-methyl-2,4-dioxo-1,3-diazinan-1-yl)oxolan-2-yl]methyl 12-azidododecanoate

Drug info:

PubChemData

Smile

CC1C(OP2(N1C)(OC(=C(O2)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

DOS

IR

Vibrations