Geometry & MOs

Info

ID:	44865
PubChem CID:	10506232
Reduced:	SeSiO2C28H48 (1)
Stoich.:	ABC2D28E48 (1)
Weight, g/mol:	521.95962
ΔH_f, kcal/mol:	-161.86
Dipole, Da:	1.99
IP(EA), eV:	-8.48(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3R,4R,5S)-3,4-diacetyloxy-5-(2-bromo-4,5-dichlorobenzimidazol-1-yl)oxolan-2-yl]methyl acetate

Drug info:

PubChemData

Smile

CC/C(=C\CCC(=C)C(C([C@@H](C)[C@@H](C)CO[Si](C)(C)C(C)(C)C)[Se]C1=CC=CC=C1)O)/C

DOS

IR

Vibrations