Geometry & MOs

Info

ID:	155181
PubChem CID:	56320930
Reduced:	ClN2O2C15H17 (1)
Stoich.:	AB2C2D15E17 (1)
Weight, g/mol:	314.070069
ΔH_f, kcal/mol:	-47.71
Dipole, Da:	6.09
IP(EA), eV:	-9.09(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-propyl-2-[3-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CCCNC(=O)C1=CC(=C(C=C1OC)N2C=CC=C2)Cl

DOS

IR

Vibrations