Geometry & MOs

Info

ID:	264901
PubChem CID:	103502132
Reduced:	ClSO2N3C13H20 (1)
Stoich.:	ABC2D3E13F20 (1)
Weight, g/mol:	257.09644
ΔH_f, kcal/mol:	-85.62
Dipole, Da:	5.29
IP(EA), eV:	-9.4(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-aminopyridin-4-yl)-(6-fluoro-2,3-dihydroindol-1-yl)methanone

Drug info:

PubChemData

Smile

CC(C)C1CCN(CC1)S(=O)(=O)C2=CC(=C(N=C2)N)Cl

DOS

IR

Vibrations