Geometry & MOs

Info

ID:	377999
PubChem CID:	134224067
Reduced:	NF3O3H14C19 (1)
Stoich.:	AB3C3D14E19 (1)
Weight, g/mol:	413.079426
ΔH_f, kcal/mol:	-216.98
Dipole, Da:	4.0
IP(EA), eV:	-9.53(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(4-chlorophenyl)-2-methyl-6-(trifluoromethyl)indol-3-yl]-phenylmethanone

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C2=C(N1)C=C(C=C2)C(F)(F)F)C(=O)C3=CC=CC=C3

DOS

IR

Vibrations