Geometry & MOs

Info

ID:	338078
PubChem CID:	127258709
Reduced:	SO4C14H18 (1)
Stoich.:	AB4C14D18 (1)
Weight, g/mol:	383.37633
ΔH_f, kcal/mol:	-147.86
Dipole, Da:	8.12
IP(EA), eV:	-8.74(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(dimethylamino)octadecyl butanoate

Drug info:

PubChemData

Smile

CC(=O)CC(=O)OCCCCS(=O)C1=CC=CC=C1

DOS

IR

Vibrations