Geometry & MOs

Info

ID:	286579
PubChem CID:	104178923
Reduced:	BrON6C9H9 (1)
Stoich.:	ABC6D9E9 (1)
Weight, g/mol:	282.03678
ΔH_f, kcal/mol:	61.64
Dipole, Da:	5.68
IP(EA), eV:	-9.48(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-bromo-5-methylpyridin-3-yl)-2,2-dimethylcyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CN=C1Br)NC(=O)CN2C=NN=N2

DOS

IR

Vibrations