Geometry & MOs

Info

ID:	69344
PubChem CID:	46530766
Reduced:	NO4C22H27 (1)
Stoich.:	AB4C22D27 (1)
Weight, g/mol:	390.122498
ΔH_f, kcal/mol:	-147.95
Dipole, Da:	3.01
IP(EA), eV:	-8.93(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methyl-1-methylsulfonyl-2,3-dihydroindol-5-yl)-[3-(trifluoromethyl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=CC=C1OCC(=O)NCCC2=CC=C(C=C2)C(=O)OC

DOS

IR

Vibrations