Geometry & MOs

Info

ID:	249704
PubChem CID:	103091453
Reduced:	ClNOC11H14 (1)
Stoich.:	ABCD11E14 (1)
Weight, g/mol:	168.07212
ΔH_f, kcal/mol:	-20.36
Dipole, Da:	3.62
IP(EA), eV:	-8.72(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-(2-methyl-1,3-thiazol-4-yl)but-3-en-2-amine

Drug info:

PubChemData

Smile

CC(/C=C/C1=CC(=C(C=C1)OC)Cl)N

DOS

IR

Vibrations