Geometry & MOs

Info

ID:	82311
PubChem CID:	49855879
Reduced:	OSN5C18H21 (1)
Stoich.:	ABC5D18E21 (1)
Weight, g/mol:	355.146681
ΔH_f, kcal/mol:	31.47
Dipole, Da:	3.1
IP(EA), eV:	-9.2(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC(CCC1CNC(=O)C2=C3C(=NC=C2)N=C(N3)C4=CC=CS4)N

DOS

IR

Vibrations