Geometry & MOs

Info

ID:	198071
PubChem CID:	79042841
Reduced:	N2O4H10C15 (1)
Stoich.:	A2B4C10D15 (1)
Weight, g/mol:	284.109568
ΔH_f, kcal/mol:	-91.04
Dipole, Da:	3.78
IP(EA), eV:	-9.71(-2.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-methylpyridin-3-yl)amino]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=N1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O

DOS

IR

Vibrations