Geometry & MOs

Info

ID:	52867
PubChem CID:	14709106
Reduced:	SO2N3H11C14 (1)
Stoich.:	AB2C3D11E14 (1)
Weight, g/mol:	376.063011
ΔH_f, kcal/mol:	-8.16
Dipole, Da:	2.24
IP(EA), eV:	-8.52(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-amino-5-pyridin-4-ylthieno[2,3-b]pyridin-2-yl)-(4-nitrophenyl)methanone

Drug info:

PubChemData

Smile

COC(=O)C1=C(C2=C(S1)N=CC(=C2)C3=CC=NC=C3)N

DOS

IR

Vibrations