Geometry & MOs

Info

ID:	46003
PubChem CID:	10520302
Reduced:	NCl2O4H11C14 (1)
Stoich.:	AB2C4D11E14 (1)
Weight, g/mol:	328.297745
ΔH_f, kcal/mol:	-141.29
Dipole, Da:	8.53
IP(EA), eV:	-9.36(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2S)-1-dodecoxypropan-2-yl]oxyoxane

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C2=C(N1)C=C(C=C2Cl)Cl)/C=C/C(=O)O

DOS

IR

Vibrations