Geometry & MOs

Info

ID:	44431
PubChem CID:	10503556
Reduced:	SiN2O7C20H38 (1)
Stoich.:	AB2C7D20E38 (1)
Weight, g/mol:	446.248851
ΔH_f, kcal/mol:	-390.52
Dipole, Da:	4.45
IP(EA), eV:	-9.48(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-2-[2-[(2R,3S)-3-[tert-butyl(dimethyl)silyl]oxyoxan-2-yl]ethynyl]-3-phenylmethoxyoxan-2-ol

Drug info:

PubChemData

Smile

C[C@@H](C(=O)OCC[Si](C)(C)C)N(C)C(=O)CC[C@H](C(=O)OC)NC(=O)OC(C)(C)C

DOS

IR

Vibrations