Geometry & MOs

Info

ID:	443414
PubChem CID:	135258924
Reduced:	F3N3O5C13H18 (1)
Stoich.:	A3B3C5D13E18 (1)
Weight, g/mol:	395.205636
ΔH_f, kcal/mol:	-272.42
Dipole, Da:	7.62
IP(EA), eV:	-9.27(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-[4-(2,2-dimethylpropanoylcarbamoyl)-5-hydroxyimidazol-1-yl]oxolan-2-yl]methyl 2,2-dimethylpropanoate

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1OC(F)(F)F)[N+](=O)[O-])NCCOCCOCCN

DOS

IR

Vibrations