Geometry & MOs

Info

ID:	272060
PubChem CID:	103722307
Reduced:	BrFN2O2C13H16 (1)
Stoich.:	ABC2D2E13F16 (1)
Weight, g/mol:	273.147727
ΔH_f, kcal/mol:	-114.13
Dipole, Da:	1.45
IP(EA), eV:	-9.81(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]-1H-indole-3-carboxamide

Drug info:

PubChemData

Smile

CC(CN(C)C(=O)C1=CC(=C(C=C1)Br)F)C(=O)NC

DOS

IR

Vibrations