Geometry & MOs

Info

ID:	712
PubChem CID:	3239
Reduced:	O3C14H24 (2)
Stoich.:	A3B14C24 (2)
Weight, g/mol:	480.345089
ΔH_f, kcal/mol:	-344.39
Dipole, Da:	5.37
IP(EA), eV:	-9.96(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

15-(3,4-dihydroxy-5,6-dimethylheptan-2-yl)-4,5-dihydroxy-2,16-dimethyl-9-oxatetracyclo[9.7.0.02,7.012,16]octadecan-8-one

Drug info:

PubChemData

Smile

CC(C)C(C)C(C(C(C)C1CCC2C1(CCC3C2COC(=O)C4C3(CC(C(C4)O)O)C)C)O)O

DOS

IR

Vibrations