Geometry & MOs

Info

ID:	394673
PubChem CID:	135023487
Reduced:	NSSiO5C29H49 (1)
Stoich.:	ABCD5E29F49 (1)
Weight, g/mol:	364.243372
ΔH_f, kcal/mol:	-297.41
Dipole, Da:	2.88
IP(EA), eV:	-8.82(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3R,6R)-3-[tert-butyl(dimethyl)silyl]oxy-2-methyl-6-phenylmethoxyheptanal

Drug info:

PubChemData

Smile

C[C@H](CC[C@H]([C@H](C)[C@@H](CC(=O)N1[C@H](COC1=S)C(C)C)O)O[Si](C)(C)C(C)(C)C)OCC2=CC=CC=C2

DOS

IR

Vibrations