Geometry & MOs

Info

ID:	430438
PubChem CID:	135170502
Reduced:	N2O5C15H22 (1)
Stoich.:	A2B5C15D22 (1)
Weight, g/mol:	308.137222
ΔH_f, kcal/mol:	-167.07
Dipole, Da:	1.77
IP(EA), eV:	-9.27(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(5-tert-butyl-1,2-oxazol-3-yl)-3-methyl-5-oxo-2H-pyrrol-2-yl] ethyl carbonate

Drug info:

PubChemData

Smile

CCOC(=O)OC1C(=CC(N1C2=NOC(=C2)C(C)(C)C)O)C

DOS

IR

Vibrations