Geometry & MOs

Info

ID:	272691
PubChem CID:	103751828
Reduced:	BrON2C11H15 (1)
Stoich.:	ABC2D11E15 (1)
Weight, g/mol:	270.03678
ΔH_f, kcal/mol:	-37.16
Dipole, Da:	4.89
IP(EA), eV:	-10.13(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-pentan-3-ylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations