Geometry & MOs

Info

ID:	19278
PubChem CID:	559817
Reduced:	O4C23H40 (1)
Stoich.:	A4B23C40 (1)
Weight, g/mol:	380.29266
ΔH_f, kcal/mol:	-230.05
Dipole, Da:	3.53
IP(EA), eV:	-10.1(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(hydroxymethyl)-6-[4-(4-pentylcyclohexyl)cyclohexyl]oxy-3,6-dihydro-2H-pyran-3-ol

Drug info:

PubChemData

Smile

CCCCCC1CCC(CC1)C2CCC(CC2)OC3C=CC(C(O3)CO)O

DOS

IR

Vibrations