Geometry & MOs

Info

ID:	383465
PubChem CID:	134975204
Reduced:	Si2O4C25H46 (1)
Stoich.:	A2B4C25D46 (1)
Weight, g/mol:	269.14472
ΔH_f, kcal/mol:	-305.65
Dipole, Da:	3.21
IP(EA), eV:	-9.02(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-nitro-2-(4-trimethylsilylbut-2-enyl)cyclohexan-1-one

Drug info:

PubChemData

Smile

CC[C@H]([C@H]1[C@H]([C@@H]([C@H](O1)C2=CC=CC=C2)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O

DOS

IR

Vibrations