Geometry & MOs

Info

ID:	282453
PubChem CID:	103927877
Reduced:	FN2O3C14H19 (1)
Stoich.:	AB2C3D14E19 (1)
Weight, g/mol:	269.137556
ΔH_f, kcal/mol:	-180.11
Dipole, Da:	3.58
IP(EA), eV:	-9.49(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-3,3-dimethyl-2-[(3-methyl-1,2-oxazol-5-yl)methylcarbamoylamino]butanoic acid

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1F)NC(=O)N[C@@H](C(=O)O)C(C)(C)C

DOS

IR

Vibrations