Geometry & MOs

Info

ID:	272697
PubChem CID:	103751862
Reduced:	BrON2C9H11 (1)
Stoich.:	ABC2D9E11 (1)
Weight, g/mol:	296.05243
ΔH_f, kcal/mol:	-24.77
Dipole, Da:	4.9
IP(EA), eV:	-10.16(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-(cyclopropylmethyl)-N-propylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCCNC(=O)C1=CC(=NC=C1)Br

DOS

IR

Vibrations