Geometry & MOs

Info

ID:	55033
PubChem CID:	17389682
Reduced:	NO5C16H23 (1)
Stoich.:	AB5C16D23 (1)
Weight, g/mol:	231.147058
ΔH_f, kcal/mol:	-202.36
Dipole, Da:	3.23
IP(EA), eV:	-8.92(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

oxalic acid;2-pentan-3-ylpyrrolidine

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CC2CCCCCN2.C(=O)(C(=O)O)O

DOS

IR

Vibrations