Geometry & MOs

Info

ID:	51554
PubChem CID:	12014245
Reduced:	O3C19H30 (1)
Stoich.:	A3B19C30 (1)
Weight, g/mol:	272.235145
ΔH_f, kcal/mol:	-127.01
Dipole, Da:	1.84
IP(EA), eV:	-9.21(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S,5R)-5-[(E)-2-(2-methoxyethoxy)ethenyl]undecan-4-ol

Drug info:

PubChemData

Smile

CCCCCC[C@H](/C=C/OCCOC)[C@@H](C1=CC=CC=C1)O

DOS

IR

Vibrations