Geometry & MOs

Info

ID:	143090
PubChem CID:	53144645
Reduced:	ClO2N4C19H21 (1)
Stoich.:	AB2C4D19E21 (1)
Weight, g/mol:	343.135448
ΔH_f, kcal/mol:	-27.01
Dipole, Da:	2.79
IP(EA), eV:	-8.71(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(1-propylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzenesulfonamide

Drug info:

PubChemData

Smile

COCCN1C=C(C2=C1N=CC=C2)CCNC(=O)NC3=CC=CC=C3Cl

DOS

IR

Vibrations