Geometry & MOs

Info

ID:	265334
PubChem CID:	103517679
Reduced:	BrN3C11H18 (1)
Stoich.:	AB3C11D18 (1)
Weight, g/mol:	243.03711
ΔH_f, kcal/mol:	14.35
Dipole, Da:	4.33
IP(EA), eV:	-8.63(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-4-N-methyl-4-N-propylpyridine-3,4-diamine

Drug info:

PubChemData

Smile

CCCN(C1=C(C=NC=C1N)Br)C(C)C

DOS

IR

Vibrations