Geometry & MOs

Info

ID:	130475
PubChem CID:	51090928
Reduced:	OF3N4C15H17 (1)
Stoich.:	AB3C4D15E17 (1)
Weight, g/mol:	345.130026
ΔH_f, kcal/mol:	-150.87
Dipole, Da:	7.82
IP(EA), eV:	-9.31(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-nitrophenyl)-N-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]acetamide

Drug info:

PubChemData

Smile

C1CN(CC1CNC(=O)C2=NNC3=CC=CC=C32)CC(F)(F)F

DOS

IR

Vibrations