Geometry & MOs

Info

ID:	45537
PubChem CID:	10514622
Reduced:	NO5H9C12 (1)
Stoich.:	AB5C9D12 (1)
Weight, g/mol:	247.095691
ΔH_f, kcal/mol:	-87.16
Dipole, Da:	5.19
IP(EA), eV:	-9.52(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-hydroxy-1-[1-(5-pyridin-2-ylfuran-2-yl)ethyl]urea

Drug info:

PubChemData

Smile

COC(=O)C1=CC=CC2=CC(=CC(=C21)O)[N+](=O)[O-]

DOS

IR

Vibrations