Geometry & MOs

Info

ID:	413949
PubChem CID:	135086900
Reduced:	NO4C28H33 (1)
Stoich.:	AB4C28D33 (1)
Weight, g/mol:	294.082684
ΔH_f, kcal/mol:	-131.45
Dipole, Da:	4.83
IP(EA), eV:	-9.19(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-prop-1-en-2-ylphenyl)-1,3-benzothiazole-6-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC(CC1)C(=C)CC(C(=O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3

DOS

IR

Vibrations