Geometry & MOs

Info

ID:	151469
PubChem CID:	53812446
Reduced:	OC11H19 (2)
Stoich.:	AB11C19 (2)
Weight, g/mol:	194.141913
ΔH_f, kcal/mol:	-125.9
Dipole, Da:	4.98
IP(EA), eV:	-9.18(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-methyl-N-(2-methylbut-3-yn-2-yl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CCCCCC=CCC(=CCC=CCCCCC(C)CC(=O)O)C

DOS

IR

Vibrations