Geometry & MOs

Info

ID:	252368
PubChem CID:	103110854
Reduced:	ON4C15H20 (1)
Stoich.:	AB4C15D20 (1)
Weight, g/mol:	296.11207
ΔH_f, kcal/mol:	-0.79
Dipole, Da:	1.79
IP(EA), eV:	-8.49(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]amino]-5-nitropyridine-2-carboxylic acid

Drug info:

PubChemData

Smile

CCCOC1=NC(=NC=C1)NCC2=C(C(=CC=C2)N)C

DOS

IR

Vibrations