Geometry & MOs

Info

ID:	259554
PubChem CID:	103167962
Reduced:	N2O2C17H22 (1)
Stoich.:	A2B2C17D22 (1)
Weight, g/mol:	295.1606
ΔH_f, kcal/mol:	-45.74
Dipole, Da:	0.38
IP(EA), eV:	-8.95(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-tert-butyl-1,3-thiazol-2-yl)-3-(3-ethoxycyclobutyl)propan-2-one

Drug info:

PubChemData

Smile

CCOC1CC(C1)CC(=O)CC2=NC3=CC=CC=C3N2C

DOS

IR

Vibrations