Geometry & MOs

Info

ID:	337946
PubChem CID:	127258569
Reduced:	O5C12H22 (1)
Stoich.:	A5B12C22 (1)
Weight, g/mol:	397.355594
ΔH_f, kcal/mol:	-251.47
Dipole, Da:	2.39
IP(EA), eV:	-10.0(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-acetamidooctadecyl butanoate

Drug info:

PubChemData

Smile

CCCC(=O)OCCCCOCC(=O)OCC

DOS

IR

Vibrations