Geometry & MOs

Info

ID:	296534
PubChem CID:	117581936
Reduced:	SN3C14H15 (1)
Stoich.:	AB3C14D15 (1)
Weight, g/mol:	259.077933
ΔH_f, kcal/mol:	61.91
Dipole, Da:	6.49
IP(EA), eV:	-8.93(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-ethoxy-3-methylanilino)-1,3-thiazole-5-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1C)NC2=NC=C(S2)C#N)C)C

DOS

IR

Vibrations