Geometry & MOs

Info

ID:	349760
PubChem CID:	127275959
Reduced:	OSN4C18H20 (1)
Stoich.:	ABC4D18E20 (1)
Weight, g/mol:	330.140199
ΔH_f, kcal/mol:	31.04
Dipole, Da:	2.26
IP(EA), eV:	-8.75(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]oxane-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)CC(C)C)C(=O)N2CCN3C2=NC4=CC=CC=C43

DOS

IR

Vibrations