Geometry & MOs

Info

ID:	235642
PubChem CID:	92710287
Reduced:	O2N3C26H31 (1)
Stoich.:	A2B3C26D31 (1)
Weight, g/mol:	410.124212
ΔH_f, kcal/mol:	-41.93
Dipole, Da:	3.42
IP(EA), eV:	-8.63(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-benzoyl-N-[2-(trifluoromethyl)phenyl]-2,3-dihydroindole-2-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)N2CCN(CC2)C(=O)[C@H]3CC4=CC=CC=C4N3C(=O)C5=CC=CC=C5

DOS

IR

Vibrations