Geometry & MOs

Info

ID:	386531
PubChem CID:	134982051
Reduced:	NO2C11H13 (1)
Stoich.:	AB2C11D13 (1)
Weight, g/mol:	520.358401
ΔH_f, kcal/mol:	-36.62
Dipole, Da:	4.33
IP(EA), eV:	-9.34(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl-[(Z,2S,3S,4S)-3-[(4-methoxyphenyl)methoxy]-2,4-dimethyl-9-(oxan-2-yloxy)non-5-enoxy]-dimethylsilane

Drug info:

PubChemData

Smile

COC(=O)C(C#N)[C@@H]1CCC=CC=C1

DOS

IR

Vibrations