Geometry & MOs

Info

ID:	153789
PubChem CID:	56313100
Reduced:	FO2N6C24H25 (1)
Stoich.:	AB2C6D24E25 (1)
Weight, g/mol:	471.180347
ΔH_f, kcal/mol:	3.96
Dipole, Da:	4.23
IP(EA), eV:	-8.8(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CN(CCN1CCNC(=O)/C=C/C2=CC(=C(C=C2)OC3=CN=CC=C3)F)C4=NC=CC=N4

DOS

IR

Vibrations