Geometry & MOs

Info

ID:	271855
PubChem CID:	103694349
Reduced:	BrN2C9H13 (1)
Stoich.:	AB2C9D13 (1)
Weight, g/mol:	228.02621
ΔH_f, kcal/mol:	17.35
Dipole, Da:	3.0
IP(EA), eV:	-9.5(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-(3-bromopyridin-2-yl)butan-1-amine

Drug info:

PubChemData

Smile

CCC[C@H](C1=C(C=CC=N1)Br)N

DOS

IR

Vibrations