Geometry & MOs

Info

ID:	283646
PubChem CID:	103995443
Reduced:	ClON4H11C14 (1)
Stoich.:	ABC4D11E14 (1)
Weight, g/mol:	284.209993
ΔH_f, kcal/mol:	58.86
Dipole, Da:	6.6
IP(EA), eV:	-8.69(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-ethylhexylcarbamoyl)-2-methylpyrrolidine-2-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C(C(=O)N(N2)C3=C(N=CC=C3)Cl)N

DOS

IR

Vibrations