Geometry & MOs

Info

ID:	128824
PubChem CID:	51059969
Reduced:	NCl2O2C27H47 (1)
Stoich.:	AB2C2D27E47 (1)
Weight, g/mol:	284.064451
ΔH_f, kcal/mol:	-101.95
Dipole, Da:	29.1
IP(EA), eV:	-6.21(-2.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(methoxycarbonylamino)-2,6-dimethyl-4-oxopyridine-3,5-dicarboxylic acid

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCC(C(=O)OCC)[N+](C)(C)CC1=CC=C(C=C1)Cl.[Cl-]

DOS

IR

Vibrations