Geometry & MOs

Info

ID:	266952
PubChem CID:	103580198
Reduced:	BrClON2C9H12 (1)
Stoich.:	ABCD2E9F12 (1)
Weight, g/mol:	303.01379
ΔH_f, kcal/mol:	-39.1
Dipole, Da:	4.12
IP(EA), eV:	-8.64(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromo-3-chloropyridin-2-yl)-N,N-dimethylpyrrolidin-3-amine

Drug info:

PubChemData

Smile

CC(C)(CNC1=C(C=C(C=N1)Br)Cl)O

DOS

IR

Vibrations