Geometry & MOs

Info

ID:	379971
PubChem CID:	134964413
Reduced:	O2N3C13H27 (1)
Stoich.:	A2B3C13D27 (1)
Weight, g/mol:	231.089543
ΔH_f, kcal/mol:	-132.43
Dipole, Da:	2.65
IP(EA), eV:	-9.62(0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[(3S)-2,5-dioxo-1-phenylpyrrolidin-3-yl]propanal

Drug info:

PubChemData

Smile

CC(C)C[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)NC)N

DOS

IR

Vibrations