Geometry & MOs

Info

ID:	70169
PubChem CID:	47208318
Reduced:	ClOSN2H11C12 (1)
Stoich.:	ABCD2E11F12 (1)
Weight, g/mol:	274.113984
ΔH_f, kcal/mol:	-5.14
Dipole, Da:	3.04
IP(EA), eV:	-9.03(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-butylphenyl)-4-methyl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1Cl)NC(=O)C2=C(N=CS2)C

DOS

IR

Vibrations