Geometry & MOs

Info

ID:	45501
PubChem CID:	10514236
Reduced:	BrOC11H13 (1)
Stoich.:	ABC11D13 (1)
Weight, g/mol:	241.081104
ΔH_f, kcal/mol:	-11.76
Dipole, Da:	2.47
IP(EA), eV:	-8.94(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3-azido-2-hydroxypropoxy)methyl]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)Br)CCC=C

DOS

IR

Vibrations