Geometry & MOs

Info

ID:	342643
PubChem CID:	127265803
Reduced:	OCl2N4H8C12 (1)
Stoich.:	AB2C4D8E12 (1)
Weight, g/mol:	273.03644
ΔH_f, kcal/mol:	78.78
Dipole, Da:	3.44
IP(EA), eV:	-9.68(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-bromofuran-2-yl)methylamino]hex-4-en-1-ol

Drug info:

PubChemData

Smile

CN1C(=CN=N1)C=C(C2=NC3=C(O2)C(=CC=C3)Cl)Cl

DOS

IR

Vibrations