Geometry & MOs

Info

ID:	224694
PubChem CID:	85346926
Reduced:	FeSiC27H30 (1)
Stoich.:	ABC27D30 (1)
Weight, g/mol:	445.268905
ΔH_f, kcal/mol:	147.87
Dipole, Da:	5.06
IP(EA), eV:	-7.68(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6-dicyclohexyl-12,14-dimethyl-2,4,6,12,14-pentazatricyclo[8.4.0.03,8]tetradecane-5,7,11,13-tetrone

Drug info:

PubChemData

Smile

C[Si](C)(C)[C]1[CH][CH][CH][C]1C(CC2=CC=CC=C2)C3=CC=CC=C3.[CH]1[CH][CH][CH][CH]1.[Fe+2]

DOS

IR

Vibrations