Geometry & MOs

Info

ID:	170521
PubChem CID:	75247303
Reduced:	Si2O3C42H78 (1)
Stoich.:	A2B3C42D78 (1)
Weight, g/mol:	222.16198
ΔH_f, kcal/mol:	-330.1
Dipole, Da:	2.87
IP(EA), eV:	-8.78(0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethenyl-5-(hydroxymethyl)-5-methyl-7-propan-2-ylidenebicyclo[2.2.1]heptan-2-ol

Drug info:

PubChemData

Smile

CCCCC(CC(C)(C)O)C(C)C1CCC2C1(CCCC2=CC=C3CC(C(=C)C(C3)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C

DOS

IR

Vibrations