Geometry & MOs

Info

ID:	21540
PubChem CID:	588875
Reduced:	ClOSN3H16C20 (1)
Stoich.:	ABCD3E16F20 (1)
Weight, g/mol:	381.070261
ΔH_f, kcal/mol:	14.48
Dipole, Da:	4.3
IP(EA), eV:	-8.28(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-5-chloro-4,6-dimethyl-N-naphthalen-2-ylthieno[2,3-b]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C2C(=C(SC2=NC(=C1Cl)C)C(=O)NC3=CC4=CC=CC=C4C=C3)N

DOS

IR

Vibrations