Geometry & MOs

Info

ID:	271412
PubChem CID:	103675432
Reduced:	BrN2O2C9H13 (1)
Stoich.:	AB2C2D9E13 (1)
Weight, g/mol:	273.03644
ΔH_f, kcal/mol:	-55.53
Dipole, Da:	2.83
IP(EA), eV:	-9.52(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3-bromofuran-2-yl)methylamino]cyclohexan-1-ol

Drug info:

PubChemData

Smile

CC(C(=O)NC)NCC1=C(C=CO1)Br

DOS

IR

Vibrations