Geometry & MOs

Info

ID:	379301
PubChem CID:	134357545
Reduced:	NO2C10H12 (2)
Stoich.:	AB2C10D12 (2)
Weight, g/mol:	365.03392
ΔH_f, kcal/mol:	-84.51
Dipole, Da:	5.01
IP(EA), eV:	-9.77(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromo-2,6-difluorophenyl)-3-(methylaminomethyl)-1H-indol-6-amine

Drug info:

PubChemData

Smile

CC12CC=C(CC(C1=CCCC2=O)(C#N)C#N)COC(=O)OC(C)(C)C

DOS

IR

Vibrations