Geometry & MOs

Info

ID:	290045
PubChem CID:	104402456
Reduced:	SO2N3C14H19 (1)
Stoich.:	AB2C3D14E19 (1)
Weight, g/mol:	264.12224
ΔH_f, kcal/mol:	-30.55
Dipole, Da:	3.06
IP(EA), eV:	-9.44(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-6-[[1-(cyclopropylamino)-1-oxopropan-2-yl]amino]pyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)NC(=O)C(C)NC(=O)C1=CSC(=C1)C#CCN

DOS

IR

Vibrations