Geometry & MOs

Info

ID:	75514
PubChem CID:	48423583
Reduced:	NF3O3C16H20 (1)
Stoich.:	AB3C3D16E20 (1)
Weight, g/mol:	397.124941
ΔH_f, kcal/mol:	-256.34
Dipole, Da:	5.14
IP(EA), eV:	-9.35(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-oxo-3-phenyl-1-[[6-(2,2,2-trifluoroethoxy)pyridin-3-yl]amino]propan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)NCC1=CC(=CC=C1)OCC(F)(F)F)OCC2CC2

DOS

IR

Vibrations