Geometry & MOs

Info

ID:	265355
PubChem CID:	103518106
Reduced:	BrN3C14H22 (1)
Stoich.:	AB3C14D22 (1)
Weight, g/mol:	324.09496
ΔH_f, kcal/mol:	8.08
Dipole, Da:	4.12
IP(EA), eV:	-8.77(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-4-(3-piperidin-1-ylpyrrolidin-1-yl)pyridin-3-amine

Drug info:

PubChemData

Smile

CCC1(CCN(CC1)C2=C(C=NC=C2N)Br)CC

DOS

IR

Vibrations