Geometry & MOs

Info

ID:	25540
PubChem CID:	626305
Reduced:	ON2C19H22 (1)
Stoich.:	AB2C19D22 (1)
Weight, g/mol:	294.046299
ΔH_f, kcal/mol:	17.0
Dipole, Da:	1.48
IP(EA), eV:	-8.33(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-hydroxyphenyl)methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one

Drug info:

PubChemData

Smile

CC=C1CN2CCC34C2C(C1C(=C)C3NC5=CC=CC=C45)O

DOS

IR

Vibrations