Geometry & MOs

Info

ID:	170609
PubChem CID:	75258631
Reduced:	OSN4C15H20 (1)
Stoich.:	ABC4D15E20 (1)
Weight, g/mol:	332.047631
ΔH_f, kcal/mol:	18.26
Dipole, Da:	5.14
IP(EA), eV:	-9.04(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(6-chloro-2-fluoro-3-methoxyphenyl)-5,7a-dihydro-1H-imidazo[4,5-f]benzimidazol-2-one

Drug info:

PubChemData

Smile

CC1=C(SC=C1)CN(C)C2=NC(=O)C3CCNCCC3=N2

DOS

IR

Vibrations