Geometry & MOs

Info

ID:	397482
PubChem CID:	135030272
Reduced:	OSiC24H26 (1)
Stoich.:	ABC24D26 (1)
Weight, g/mol:	358.175292
ΔH_f, kcal/mol:	60.6
Dipole, Da:	2.82
IP(EA), eV:	-8.91(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

phenyl-[(1S,4R)-3-[(1S,4R)-3-trimethylsilyl-2-bicyclo[2.2.1]hepta-2,5-dienyl]-2-bicyclo[2.2.1]hepta-2,5-dienyl]methanone

Drug info:

PubChemData

Smile

C[Si](C)(C)C1=C([C@@H]2C[C@H]1C=C2)C3=C([C@H]4C[C@@H]3C=C4)C(=O)C5=CC=CC=C5

DOS

IR

Vibrations