Geometry & MOs

Info

ID:	225077
PubChem CID:	85741438
Reduced:	BrN3C14H14 (1)
Stoich.:	AB3C14D14 (1)
Weight, g/mol:	150.104465
ΔH_f, kcal/mol:	65.71
Dipole, Da:	3.46
IP(EA), eV:	-8.81(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

deca-3,9-diyn-2-ol

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=NC=CN=C3N2CCCCBr

DOS

IR

Vibrations