Geometry & MOs

Info

ID:	191151
PubChem CID:	78112135
Reduced:	N3O6C18H19 (1)
Stoich.:	A3B6C18D19 (1)
Weight, g/mol:	570.314168
ΔH_f, kcal/mol:	-173.34
Dipole, Da:	5.54
IP(EA), eV:	-8.99(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[tert-butyl(dimethyl)silyl]oxy-2,6-dimethyl-5-methylidene-7-phenylmethoxyheptan-3-yl] 2-diethoxyphosphorylacetate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C#CC2=CN(C(=O)N=C2N)C3C(C(C(C(O3)CO)O)O)O

DOS

IR

Vibrations