Geometry & MOs

Info

ID:	426053
PubChem CID:	135135549
Reduced:	OSN5C15H19 (1)
Stoich.:	ABC5D15E19 (1)
Weight, g/mol:	442.165032
ΔH_f, kcal/mol:	26.24
Dipole, Da:	4.96
IP(EA), eV:	-8.98(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-[[3-[(2,6-dimethylpyridin-4-yl)oxymethyl]-5-(trifluoromethyl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide

Drug info:

PubChemData

Smile

CC(=O)NC1=NC=C(S1)CN2CCC(C2)CC3=CN=CN=C3

DOS

IR

Vibrations