Geometry & MOs

Info

ID:	216702
PubChem CID:	85086638
Reduced:	N4O5C12H14 (1)
Stoich.:	A4B5C12D14 (1)
Weight, g/mol:	296.11207
ΔH_f, kcal/mol:	-85.11
Dipole, Da:	2.42
IP(EA), eV:	-9.42(-2.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-hydroxy-5-(hydroxymethyl)-3-imidazol-1-yloxolan-2-yl]-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CCOC(=O)C=C(N)NNC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

DOS

IR

Vibrations