Geometry & MOs

Info

ID:	383446
PubChem CID:	134975177
Reduced:	RuO5C16H30 (1)
Stoich.:	AB5C16D30 (1)
Weight, g/mol:	270.219495
ΔH_f, kcal/mol:	-86.18
Dipole, Da:	2.41
IP(EA), eV:	-8.83(-3.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,1S)-1-[(2S,5R)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-4-methylhept-4-en-1-ol

Drug info:

PubChemData

Smile

CC/C=C(\C)/CC[C@@H]([C@@]1(CC[C@@H](O1)C(C)(C)O)C)O.O=[Ru]=O

DOS

IR

Vibrations