Geometry & MOs

Info

ID:	82306
PubChem CID:	49855874
Reduced:	O6C21H28 (1)
Stoich.:	A6B21C28 (1)
Weight, g/mol:	341.131031
ΔH_f, kcal/mol:	-266.39
Dipole, Da:	6.03
IP(EA), eV:	-8.62(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-aminocyclohexyl)-2-thiophen-2-yl-1H-imidazo[4,5-b]pyridine-7-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)CC(C(=O)OC2CCCC2)C(=O)OC3CCCC3)O

DOS

IR

Vibrations