Geometry & MOs

Info

ID:	413409
PubChem CID:	135086358
Reduced:	NRhC17H26 (1)
Stoich.:	ABC17D26 (1)
Weight, g/mol:	242.188195
ΔH_f, kcal/mol:	197.28
Dipole, Da:	29.59
IP(EA), eV:	-8.56(-4.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8,8-diethoxy-2-methyl-6-methylideneoct-2-en-4-ol

Drug info:

PubChemData

Smile

[CH3-].[CH3-].CC1=C([C](C(=C1C)C)C)C.C1=CC=NC=C1.[Rh+2]

DOS

IR

Vibrations