Geometry & MOs

Info

ID:	385588
PubChem CID:	134979488
Reduced:	NO3C19H29 (1)
Stoich.:	AB3C19D29 (1)
Weight, g/mol:	214.19328
ΔH_f, kcal/mol:	-138.93
Dipole, Da:	1.71
IP(EA), eV:	-9.66(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(8R)-8-methyldecyl] acetate

Drug info:

PubChemData

Smile

CC/C=C\[C@@H]1C[C@@H](C2C1C(=O)N2C(=O)OC(C)(C)C)/C=C/CC

DOS

IR

Vibrations