Geometry & MOs

Info

ID:	199790
PubChem CID:	79295510
Reduced:	BrN2O2C13H15 (1)
Stoich.:	AB2C2D13E15 (1)
Weight, g/mol:	219.083019
ΔH_f, kcal/mol:	-35.0
Dipole, Da:	4.22
IP(EA), eV:	-9.25(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,2-dimethylcyclopropyl)-3H-imidazo[4,5-c]pyridine-2-thione

Drug info:

PubChemData

Smile

CCN1C2COCC2C(=O)NC3=C1C=C(C=C3)Br

DOS

IR

Vibrations