Geometry & MOs

Info

ID:	203421
PubChem CID:	79827752
Reduced:	BrN4C12H13 (1)
Stoich.:	AB4C12D13 (1)
Weight, g/mol:	221.164046
ΔH_f, kcal/mol:	54.0
Dipole, Da:	1.26
IP(EA), eV:	-8.42(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-N-(1-methylpiperidin-3-yl)pyridine-2,3,6-triamine

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)Br)NC2=NC(=C(C=C2)N)N

DOS

IR

Vibrations