Geometry & MOs

Info

ID:	325200
PubChem CID:	126681937
Reduced:	O3C20H38 (1)
Stoich.:	A3B20C38 (1)
Weight, g/mol:	370.30831
ΔH_f, kcal/mol:	-201.39
Dipole, Da:	2.79
IP(EA), eV:	-9.57(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxybutyl (Z)-18-hydroxyoctadec-9-enoate

Drug info:

PubChemData

Smile

CCCCCC/C=C/CCCCCCCC(=O)OC(CC)CO

DOS

IR

Vibrations