Geometry & MOs

Info

ID:	282206
PubChem CID:	103918730
Reduced:	FION2C13H18 (1)
Stoich.:	ABCD2E13F18 (1)
Weight, g/mol:	299.06332
ΔH_f, kcal/mol:	-52.59
Dipole, Da:	5.8
IP(EA), eV:	-8.93(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-[3-(dimethylamino)propyl]-N-methylpyridine-4-carboxamide

Drug info:

PubChemData

Smile

CN(C)CCCN(C)C(=O)C1=C(C=C(C=C1)F)I

DOS

IR

Vibrations