Geometry & MOs

Info

ID:	153797
PubChem CID:	56313109
Reduced:	S2N3O3C23H27 (1)
Stoich.:	A2B3C3D23E27 (1)
Weight, g/mol:	483.159275
ΔH_f, kcal/mol:	-52.54
Dipole, Da:	9.36
IP(EA), eV:	-8.34(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]-N-[4,4,4-trifluoro-3-hydroxy-3-(1-methylimidazol-2-yl)butyl]propanamide

Drug info:

PubChemData

Smile

CCN(C)CC1=CC=CC(=C1)CNC(=O)C2=C(C=CS2)S(=O)(=O)NC3=CC=C(C=C3)C

DOS

IR

Vibrations