Geometry & MOs

Info

ID:	153407
PubChem CID:	56312598
Reduced:	FO3N4C26H31 (1)
Stoich.:	AB3C4D26E31 (1)
Weight, g/mol:	451.208276
ΔH_f, kcal/mol:	-116.83
Dipole, Da:	0.95
IP(EA), eV:	-9.28(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCC(CC1)NC(=O)N2CCC(CC2)NC(=O)/C=C/C3=CC(=C(C=C3)OC4=CN=CC=C4)F

DOS

IR

Vibrations