Geometry & MOs

Info

ID:

381715

PubChem CID:

134972526

Reduced:

SiO4C39H42 (1)

Stoich.:

AB4C39D42 (1)

Weight, g/mol:

602.285236

ΔHf, kcal/mol:

-115.21

Dipole, Da:

2.06

IP(EA), eV:

 -8.91(-0.1)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(5R)-5-[(E)-1-[4-[tert-butyl(diphenyl)silyl]oxy-2-phenylmethoxyphenyl]-3-hydroxyprop-1-en-2-yl]-2-methylcyclohex-2-en-1-one

Drug info:

PubChemData

Smile

CC1=CC[C@H](CC1=O)/C(=C/C2=C(C=C(C=C2)O[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C(C)(C)C)OCC5=CC=CC=C5)/CO

DOS

IR

Vibrations