Geometry & MOs

Info

ID:	154415
PubChem CID:	56313846
Reduced:	FSO3N5H22C25 (1)
Stoich.:	ABC3D5E22F25 (1)
Weight, g/mol:	403.121827
ΔH_f, kcal/mol:	21.19
Dipole, Da:	4.38
IP(EA), eV:	-9.23(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]-N-[2-(2,2,2-trifluoroethoxy)ethyl]propanamide

Drug info:

PubChemData

Smile

C1CN(CCN1CC2=NC(=NO2)C3=CC=CS3)C(=O)/C=C/C4=CC(=C(C=C4)OC5=CN=CC=C5)F

DOS

IR

Vibrations