Geometry & MOs

Info

ID:	84992
PubChem CID:	49871235
Reduced:	NOF3C14H14 (1)
Stoich.:	ABC3D14E14 (1)
Weight, g/mol:	267.087099
ΔH_f, kcal/mol:	-172.82
Dipole, Da:	6.05
IP(EA), eV:	-8.89(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-methyl-7-(trifluoromethyl)-2,3-dihydro-1H-carbazol-4-one

Drug info:

PubChemData

Smile

CN(C1=CC(=O)CCC1)C2=CC=CC(=C2)C(F)(F)F

DOS

IR

Vibrations