Geometry & MOs

Info

ID:	271854
PubChem CID:	103694340
Reduced:	ClFOC11H12 (1)
Stoich.:	ABCD11E12 (1)
Weight, g/mol:	228.02621
ΔH_f, kcal/mol:	-90.03
Dipole, Da:	2.05
IP(EA), eV:	-9.82(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)CCCCl)F

DOS

IR

Vibrations