Geometry & MOs

Info

ID:	28668
PubChem CID:	828850
Reduced:	N2O2Cl3H9C12 (1)
Stoich.:	A2B2C3D9E12 (1)
Weight, g/mol:	306.11907
ΔH_f, kcal/mol:	-57.5
Dipole, Da:	5.21
IP(EA), eV:	-9.82(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-N,4-diphenyl-3-prop-2-enyl-1,3-thiazol-2-imine

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC(=N2)C(=O)N[C@@H](C(Cl)(Cl)Cl)O

DOS

IR

Vibrations