Geometry & MOs

Info

ID:	280963
PubChem CID:	103852193
Reduced:	BrON2C12H15 (1)
Stoich.:	ABC2D12E15 (1)
Weight, g/mol:	270.086056
ΔH_f, kcal/mol:	-26.2
Dipole, Da:	2.84
IP(EA), eV:	-9.73(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclobutylethyl)-2-(4-methyl-2-sulfanylidene-3H-1,3-thiazol-5-yl)acetamide

Drug info:

PubChemData

Smile

CC(C1CCC1)NC(=O)C2=C(N=CC=C2)Br

DOS

IR

Vibrations