Geometry & MOs

Info

ID:	54234
PubChem CID:	16955361
Reduced:	SN3O3C16H21 (1)
Stoich.:	AB3C3D16E21 (1)
Weight, g/mol:	335.130363
ΔH_f, kcal/mol:	-68.5
Dipole, Da:	4.55
IP(EA), eV:	-8.25(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-dimethoxyanilino)-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CCCCNC(=O)C1=CSC(=N1)NC2=CC(=C(C=C2)OC)OC

DOS

IR

Vibrations