Geometry & MOs

Info

ID:	60970
PubChem CID:	26703740
Reduced:	ON3C20H21 (1)
Stoich.:	AB3C20D21 (1)
Weight, g/mol:	485.144299
ΔH_f, kcal/mol:	38.78
Dipole, Da:	5.58
IP(EA), eV:	-9.29(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethoxy-3-piperidin-1-ylsulfonylphenyl)-2-methyl-4-phenyl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC[C@H](CNC(=O)C1=CN(N=C1)C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations