Geometry & MOs

Info

ID:	144418
PubChem CID:	53365249
Reduced:	ClO2N5H26C27 (1)
Stoich.:	AB2C5D26E27 (1)
Weight, g/mol:	365.156184
ΔH_f, kcal/mol:	39.41
Dipole, Da:	2.18
IP(EA), eV:	-8.66(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-dimethylanilino)-4-methyl-N-[(2-methylphenyl)methyl]-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NOC(=N2)C3=C(N=CC=C3)N4CCC(CC4)C(=O)NCC5=CC=CC=C5Cl

DOS

IR

Vibrations