Geometry & MOs

Info

ID:	267487
PubChem CID:	103582361
Reduced:	BrClN2O2H14C15 (1)
Stoich.:	ABC2D2E14F15 (1)
Weight, g/mol:	347.07639
ΔH_f, kcal/mol:	-28.59
Dipole, Da:	3.87
IP(EA), eV:	-8.67(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(5-bromo-3-chloropyridin-2-yl)-1-N,1-N-diethylpentane-1,4-diamine

Drug info:

PubChemData

Smile

C1COC2=C(O1)C=CC(=C2)CCNC3=C(C=C(C=N3)Br)Cl

DOS

IR

Vibrations