Geometry & MOs

Info

ID:	264823
PubChem CID:	103493687
Reduced:	BrSN2C6O6H11 (1)
Stoich.:	ABC2D6E6F11 (1)
Weight, g/mol:	257.132826
ΔH_f, kcal/mol:	-253.04
Dipole, Da:	5.47
IP(EA), eV:	-10.0(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(6-fluoro-2,3-dihydroindol-1-yl)-6-methylpyridin-4-yl]methanamine

Drug info:

PubChemData

Smile

COC(=O)C(CNS(=O)(=O)NC(=O)OC)Br

DOS

IR

Vibrations