Geometry & MOs

Info

ID:	245131
PubChem CID:	99437684
Reduced:	F2N2S2O5H16C17 (1)
Stoich.:	A2B2C2D5E16F17 (1)
Weight, g/mol:	361.0226
ΔH_f, kcal/mol:	-245.48
Dipole, Da:	3.48
IP(EA), eV:	-9.0(-1.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-bromo-2-methylindol-1-yl)-N-(5-fluoropyridin-2-yl)acetamide

Drug info:

PubChemData

Smile

C1[C@H](CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)C(F)F)C(=O)N

DOS

IR

Vibrations