Geometry & MOs

Info

ID:	212643
PubChem CID:	81061294
Reduced:	N3O4C14H19 (1)
Stoich.:	A3B4C14D19 (1)
Weight, g/mol:	265.142641
ΔH_f, kcal/mol:	-160.65
Dipole, Da:	5.89
IP(EA), eV:	-9.33(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-carbamoyl-2,6-dimethylpyridin-4-yl)amino]-2-methylbutanoic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C(=O)N)N2CCOC(C2)CC(=O)O

DOS

IR

Vibrations