Geometry & MOs

Info

ID:	13022
PubChem CID:	220018
Reduced:	O5C23H42 (1)
Stoich.:	A5B23C42 (1)
Weight, g/mol:	398.303224
ΔH_f, kcal/mol:	-289.8
Dipole, Da:	2.26
IP(EA), eV:	-9.73(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxyethyl (12R)-12-acetyloxyoctadec-9-enoate

Drug info:

PubChemData

Smile

CCCCCC[C@H](CC=CCCCCCCCC(=O)OCCOC)OC(=O)C

DOS

IR

Vibrations