Geometry & MOs

Info

ID:	128823
PubChem CID:	51059829
Reduced:	O5H14C16 (1)
Stoich.:	A5B14C16 (1)
Weight, g/mol:	487.298385
ΔH_f, kcal/mol:	-148.82
Dipole, Da:	7.13
IP(EA), eV:	-9.4(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-chlorophenyl)methyl-(1-ethoxy-1-oxohexadecan-2-yl)-dimethylazanium;chloride

Drug info:

PubChemData

Smile

CO/C(=C/1\C2=C(CCC3=CC=CC=C3C1=O)COC2=O)/O

DOS

IR

Vibrations