Geometry & MOs

Info

ID:	385176
PubChem CID:	134978452
Reduced:	NO4H13C15 (1)
Stoich.:	AB4C13D15 (1)
Weight, g/mol:	370.160036
ΔH_f, kcal/mol:	-29.05
Dipole, Da:	9.27
IP(EA), eV:	-8.99(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,5Z,9R)-9-[tert-butyl(dimethyl)silyl]oxy-11-methoxyspiro[bicyclo[7.3.1]trideca-1(12),5,10-trien-3,7-diyne-13,2'-oxirane]-2-ol

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)/C=C/C2=CC(=C(C=C2)[N+](=O)[O-])O

DOS

IR

Vibrations