Geometry & MOs

Info

ID:	381561
PubChem CID:	134972334
Reduced:	O2C15H24 (1)
Stoich.:	A2B15C24 (1)
Weight, g/mol:	431.195042
ΔH_f, kcal/mol:	-107.29
Dipole, Da:	1.79
IP(EA), eV:	-9.26(0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3S,5S)-5-[[dimethyl(phenyl)silyl]methyl]-1-(4-methylphenyl)sulfonyl-2-propan-2-ylpyrrolidin-3-ol

Drug info:

PubChemData

Smile

CC(=C[C@@H]1[C@@H](C1(C)C)C(=O)OC2CCCC2)C

DOS

IR

Vibrations