Geometry & MOs

Info

ID:	272738
PubChem CID:	103753871
Reduced:	BrClFON2H11C14 (1)
Stoich.:	ABCDE2F11G14 (1)
Weight, g/mol:	299.06332
ΔH_f, kcal/mol:	-40.37
Dipole, Da:	5.08
IP(EA), eV:	-9.87(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-[2-(dimethylamino)-2-methylpropyl]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CN(CC1=C(C=CC=C1Cl)F)C(=O)C2=CC(=NC=C2)Br

DOS

IR

Vibrations