Geometry & MOs

Info

ID:	153286
PubChem CID:	56312463
Reduced:	O2N3F6C13H17 (1)
Stoich.:	A2B3C6D13E17 (1)
Weight, g/mol:	417.137477
ΔH_f, kcal/mol:	-386.1
Dipole, Da:	3.03
IP(EA), eV:	-9.98(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]-N-[1-(2,2,2-trifluoroethoxy)propan-2-yl]propanamide

Drug info:

PubChemData

Smile

CC(C)N1C(=C(C=N1)C(=O)NC(C)COCC(F)(F)F)C(F)(F)F

DOS

IR

Vibrations