Geometry & MOs

Info

ID:	337373
PubChem CID:	127257058
Reduced:	NO4C21H37 (1)
Stoich.:	AB4C21D37 (1)
Weight, g/mol:	353.256609
ΔH_f, kcal/mol:	-227.55
Dipole, Da:	5.65
IP(EA), eV:	-9.48(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[4-[(E)-3-hydroxyoct-1-enyl]-1-methyl-2-oxopyrrolidin-3-yl]heptanoic acid

Drug info:

PubChemData

Smile

CCCCCCC(/C=C/C1CN(C(=O)C1CCCCCCC(=O)O)C)O

DOS

IR

Vibrations