Geometry & MOs

Info

ID:	126408
PubChem CID:	50964080
Reduced:	ON4C21H28 (1)
Stoich.:	AB4C21D28 (1)
Weight, g/mol:	333.114713
ΔH_f, kcal/mol:	6.8
Dipole, Da:	6.66
IP(EA), eV:	-8.51(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(3-methoxyphenoxy)azetidin-1-yl]-N-(1,3-thiazol-2-yl)propanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC2(CCCC2)C(=O)NCC3(CC3)CN4C=CN=C4

DOS

IR

Vibrations