Geometry & MOs

Info

ID:	32199
PubChem CID:	6435867
Reduced:	SO6C22H42 (1)
Stoich.:	AB6C22D42 (1)
Weight, g/mol:	499.298385
ΔH_f, kcal/mol:	-326.94
Dipole, Da:	1.35
IP(EA), eV:	-9.52(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,4-dichlorophenyl) acetate;(Z)-N,N-dimethyloctadec-9-en-1-amine

Drug info:

PubChemData

Smile

CCCCOC(=O)CCCCCCC/C=C/CCCCCCCCOS(=O)(=O)O

DOS

IR

Vibrations