Geometry & MOs

Info

ID:	153907
PubChem CID:	56313243
Reduced:	F3N3O3C21H22 (1)
Stoich.:	A3B3C3D21E22 (1)
Weight, g/mol:	435.15699
ΔH_f, kcal/mol:	-238.98
Dipole, Da:	5.53
IP(EA), eV:	-9.06(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-N-[2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide

Drug info:

PubChemData

Smile

C1COCCN1C(CNC(=O)C2=CC=CC(=C2)C(=O)N)C3=CC=C(C=C3)C(F)(F)F

DOS

IR

Vibrations