Geometry & MOs

Info

ID:	271405
PubChem CID:	103675064
Reduced:	BrNO2C8H12 (1)
Stoich.:	ABC2D8E12 (1)
Weight, g/mol:	273.07283
ΔH_f, kcal/mol:	-60.08
Dipole, Da:	1.22
IP(EA), eV:	-9.32(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-bromofuran-2-yl)methyl]heptan-2-amine

Drug info:

PubChemData

Smile

CC(CNCC1=C(C=CO1)Br)O

DOS

IR

Vibrations