Geometry & MOs

Info

ID:	395875
PubChem CID:	135026819
Reduced:	OC3H3 (4)
Stoich.:	AB3C3 (4)
Weight, g/mol:	269.04153
ΔH_f, kcal/mol:	-137.36
Dipole, Da:	2.27
IP(EA), eV:	-9.5(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-bromopyridin-3-yl)cycloheptan-1-ol

Drug info:

PubChemData

Smile

CC1C(OC2=CC=CC=C2C1=O)C(=O)OC

DOS

IR

Vibrations