Geometry & MOs

Info

ID:	290289
PubChem CID:	104426434
Reduced:	ON5C13H19 (1)
Stoich.:	AB5C13D19 (1)
Weight, g/mol:	279.158292
ΔH_f, kcal/mol:	11.48
Dipole, Da:	2.54
IP(EA), eV:	-8.74(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[[3-(2-methylpropylamino)-3-oxopropyl]amino]pyridine-2-carboxylate

Drug info:

PubChemData

Smile

CC(C)CNC(=O)CCNC1=NN2C=CC=CC2=N1

DOS

IR

Vibrations