Geometry & MOs

Info

ID:	43157
PubChem CID:	10318954
Reduced:	SN2O2C23H34 (1)
Stoich.:	AB2C2D23E34 (1)
Weight, g/mol:	402.201507
ΔH_f, kcal/mol:	-112.04
Dipole, Da:	7.06
IP(EA), eV:	-8.82(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2R,3S)-2,4-dimethyl-3-triphenylsilylpentanoate

Drug info:

PubChemData

Smile

C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2C(=O)N4CCSCC4)CNC5=CC(=O)CC[C@]35C

DOS

IR

Vibrations