Geometry & MOs

Info

ID:	85244
PubChem CID:	49872930
Reduced:	OSN4H16C17 (1)
Stoich.:	ABC4D16E17 (1)
Weight, g/mol:	338.120132
ΔH_f, kcal/mol:	38.49
Dipole, Da:	7.2
IP(EA), eV:	-8.75(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,3-benzothiazol-6-yl)-4,4-dimethyl-3-(4-methylpyridin-3-yl)imidazolidin-2-one

Drug info:

PubChemData

Smile

CC1(CN(C(=O)N1C2=CN=CC=C2)C3=CC4=C(C=C3)N=CS4)C

DOS

IR

Vibrations