Geometry & MOs

Info

ID:	219734
PubChem CID:	85164714
Reduced:	PSiN2O6C29H45 (1)
Stoich.:	ABC2D6E29F45 (1)
Weight, g/mol:	576.25456
ΔH_f, kcal/mol:	-341.17
Dipole, Da:	8.53
IP(EA), eV:	-9.03(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-methoxy-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-yl]sulfanyl-4-methylpent-3-en-2-one

Drug info:

PubChemData

Smile

CC(C(CCNC(=O)CCC(=O)O)OP(=O)(C)OCC[Si](C)(C)C)N(CC1=CC=CC=C1)CC2=CC=CC=C2

DOS

IR

Vibrations