Geometry & MOs

Info

ID:	45510
PubChem CID:	10514322
Reduced:	O3C14H26 (1)
Stoich.:	A3B14C26 (1)
Weight, g/mol:	242.188195
ΔH_f, kcal/mol:	-145.8
Dipole, Da:	0.63
IP(EA), eV:	-9.17(1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclohexyl-2,2-diethoxybut-3-en-1-ol

Drug info:

PubChemData

Smile

CC(CCC=C(C)C)C[C@H]1C[C@@]1(O)OCCO

DOS

IR

Vibrations