Geometry & MOs

Info

ID:	281019
PubChem CID:	103852426
Reduced:	FNO2C13H16 (1)
Stoich.:	ABC2D13E16 (1)
Weight, g/mol:	298.189257
ΔH_f, kcal/mol:	-128.2
Dipole, Da:	4.95
IP(EA), eV:	-9.49(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2S,3S)-3-methyl-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]pentanoate

Drug info:

PubChemData

Smile

CC(C1CCC1)NC(=O)C2=C(C=C(C=C2)F)O

DOS

IR

Vibrations