Geometry & MOs

Info

ID:	157395
PubChem CID:	56423647
Reduced:	SO2N5H17C21 (1)
Stoich.:	AB2C5D17E21 (1)
Weight, g/mol:	436.156912
ΔH_f, kcal/mol:	64.95
Dipole, Da:	5.75
IP(EA), eV:	-9.41(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-phenoxyacetyl)-N-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=O)C(=NN1C2=CC=CC=C2)C(=O)NCC3=NC(=CS3)C4=CC=NC=C4

DOS

IR

Vibrations