Geometry & MOs

Info

ID:	190885
PubChem CID:	78071933
Reduced:	ClN3O3C23H24 (1)
Stoich.:	AB3C3D23E24 (1)
Weight, g/mol:	379.171834
ΔH_f, kcal/mol:	-48.86
Dipole, Da:	5.11
IP(EA), eV:	-8.9(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-tert-butylphenyl)-N-(1-phenoxypropan-2-ylideneamino)-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

COC1=C(OC2=C1C=C(C=C2)Cl)C(=O)NC3C4CCN(C3CC5=CN=CC=C5)CC4

DOS

IR

Vibrations