Geometry & MOs

Info

ID:	130477
PubChem CID:	51090930
Reduced:	N2F3O3C16H21 (1)
Stoich.:	A2B3C3D16E21 (1)
Weight, g/mol:	346.150427
ΔH_f, kcal/mol:	-264.19
Dipole, Da:	4.05
IP(EA), eV:	-8.67(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dimethoxy-N-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]benzamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C(=O)NCC2CCN(C2)CC(F)(F)F)OC

DOS

IR

Vibrations