Geometry & MOs

Info

ID:	397058
PubChem CID:	135029659
Reduced:	NSSiO3C18H25 (1)
Stoich.:	ABCD3E18F25 (1)
Weight, g/mol:	447.2441
ΔH_f, kcal/mol:	-93.0
Dipole, Da:	2.18
IP(EA), eV:	-8.84(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2S,3S)-3-methyl-2-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-3-trimethylsilyloxycyclohexylidene]ethyl pyridine-2-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)ON(C1=CC=CS1)C(=O)OCC2=CC=CC=C2

DOS

IR

Vibrations