Geometry & MOs

Info

ID:	267497
PubChem CID:	103582391
Reduced:	BrClON3C10H11 (1)
Stoich.:	ABCD3E10F11 (1)
Weight, g/mol:	303.01379
ΔH_f, kcal/mol:	2.16
Dipole, Da:	2.38
IP(EA), eV:	-9.16(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-N-[(1-methylpyrrolidin-3-yl)methyl]pyridin-2-amine

Drug info:

PubChemData

Smile

C1CC1NC(=O)CNC2=C(C=C(C=N2)Br)Cl

DOS

IR

Vibrations