Geometry & MOs

Info

ID:	150918
PubChem CID:	53790615
Reduced:	O8C27H50 (1)
Stoich.:	A8B27C50 (1)
Weight, g/mol:	356.256274
ΔH_f, kcal/mol:	-468.98
Dipole, Da:	4.52
IP(EA), eV:	-10.57(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[(3R)-6-(1,2-dihydroxyethyl)-3-hydroxy-2-methyloxepan-2-yl]-2,6-dimethylnon-3-en-5-one

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCC(CCCC(=O)O)C(CCCC(=O)O)(CC(CO)O)C(=O)O

DOS

IR

Vibrations