Geometry & MOs

Info

ID:	286578
PubChem CID:	104178878
Reduced:	BrON2C15H17 (1)
Stoich.:	ABC2D15E17 (1)
Weight, g/mol:	296.00212
ΔH_f, kcal/mol:	5.27
Dipole, Da:	4.65
IP(EA), eV:	-9.02(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-bromo-5-methylpyridin-3-yl)-2-(tetrazol-1-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=CN=C1Br)NC(=O)C2C3C2C4CCC3C4

DOS

IR

Vibrations