Geometry & MOs

Info

ID:	121305
PubChem CID:	50762403
Reduced:	O2S2N4H18C19 (1)
Stoich.:	A2B2C4D18E19 (1)
Weight, g/mol:	406.146347
ΔH_f, kcal/mol:	36.49
Dipole, Da:	5.57
IP(EA), eV:	-9.19(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dimethyl-N-[2-(2-phenylimidazo[4,5-b]pyridin-3-yl)ethyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NC3=C(N2CCNS(=O)(=O)C4=CC=CS4)N=CC=C3

DOS

IR

Vibrations