Geometry & MOs

Info

ID:	217916
PubChem CID:	85088575
Reduced:	NO5C24H29 (1)
Stoich.:	AB5C24D29 (1)
Weight, g/mol:	411.22297
ΔH_f, kcal/mol:	-201.52
Dipole, Da:	2.18
IP(EA), eV:	-9.56(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]-6-pyridin-3-ylhex-5-enoic acid

Drug info:

PubChemData

Smile

CCOC(=O)CC1C(N(C(O1)(C)C)C(=O)OCC2=CC=CC=C2)CC3=CC=CC=C3

DOS

IR

Vibrations