Geometry & MOs

Info

ID:	191588
PubChem CID:	78165490
Reduced:	SCl2N3C13H13 (1)
Stoich.:	AB2C3D13E13 (1)
Weight, g/mol:	327.036374
ΔH_f, kcal/mol:	60.3
Dipole, Da:	5.05
IP(EA), eV:	-8.69(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,4-dichlorophenyl)-N-(pentan-2-ylideneamino)-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

CCC(=NNC1=NC(=CS1)C2=C(C=C(C=C2)Cl)Cl)C

DOS

IR

Vibrations