Geometry & MOs

Info

ID:	288159
PubChem CID:	104312231
Reduced:	BrNOSH8C10 (1)
Stoich.:	ABCDE8F10 (1)
Weight, g/mol:	279.00072
ΔH_f, kcal/mol:	20.57
Dipole, Da:	3.44
IP(EA), eV:	-9.12(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-aminopyridin-3-yl)-(3-bromopyridin-2-yl)methanol

Drug info:

PubChemData

Smile

C1=CC(=C(N=C1)C(C2=CC=CS2)O)Br

DOS

IR

Vibrations