Geometry & MOs

Info

ID:	407739
PubChem CID:	135080494
Reduced:	O3C11H22 (1)
Stoich.:	A3B11C22 (1)
Weight, g/mol:	212.141244
ΔH_f, kcal/mol:	-185.31
Dipole, Da:	3.14
IP(EA), eV:	-10.58(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (5R)-5-hydroxyundec-6-ynoate

Drug info:

PubChemData

Smile

CC(C)CCOC(=O)CCCC(C)O

DOS

IR

Vibrations