Geometry & MOs

Info

ID:	271360
PubChem CID:	103669380
Reduced:	BrON2C12H17 (1)
Stoich.:	ABC2D12E17 (1)
Weight, g/mol:	301.98215
ΔH_f, kcal/mol:	-19.26
Dipole, Da:	1.03
IP(EA), eV:	-9.16(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-2-chloro-N-(2-ethylcyclopropyl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCC1CC1NC(=O)C2=CC(=CN2CC)Br

DOS

IR

Vibrations