Geometry & MOs

Info

ID:	176764
PubChem CID:	76095707
Reduced:	NO3H5C9 (1)
Stoich.:	AB3C5D9 (1)
Weight, g/mol:	368.29266
ΔH_f, kcal/mol:	-66.07
Dipole, Da:	4.33
IP(EA), eV:	-10.61(-2.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butanoyl 12-hydroxyoctadec-9-enoate

Drug info:

PubChemData

Smile

C1=CC(=O)C2=CC(=O)NC(=O)C2=C1

DOS

IR

Vibrations