Geometry & MOs

Info

ID:	243145
PubChem CID:	99215981
Reduced:	NO4C21H23 (1)
Stoich.:	AB4C21D23 (1)
Weight, g/mol:	392.101706
ΔH_f, kcal/mol:	-145.17
Dipole, Da:	2.97
IP(EA), eV:	-8.64(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzothiazol-2-yl)-N-(3,5-dimethylphenyl)-2-(5-methylthiophen-2-yl)acetamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC(=CC=C1)OC(=O)C[C@H]2CCCC3=C2C=CC(=C3)OC

DOS

IR

Vibrations