Geometry & MOs

Info

ID:	406655
PubChem CID:	135078256
Reduced:	NSO2C20H21 (1)
Stoich.:	ABC2D20E21 (1)
Weight, g/mol:	402.222636
ΔH_f, kcal/mol:	14.15
Dipole, Da:	6.08
IP(EA), eV:	-9.45(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R)-1-formylcyclohex-3-en-1-yl] 4-tri(propan-2-yl)silyloxybenzoate

Drug info:

PubChemData

Smile

CC#CCN([C@@H](C=C)C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C

DOS

IR

Vibrations