Geometry & MOs

Info

ID:	29718
PubChem CID:	836705
Reduced:	NOF3C14H16 (1)
Stoich.:	ABC3D14E16 (1)
Weight, g/mol:	336.054419
ΔH_f, kcal/mol:	-202.96
Dipole, Da:	4.76
IP(EA), eV:	-10.0(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methyl-1,3-benzothiazol-2-yl)-4-(trifluoromethyl)benzamide

Drug info:

PubChemData

Smile

C1CCC(CC1)NC(=O)C2=CC=C(C=C2)C(F)(F)F

DOS

IR

Vibrations