Geometry & MOs

Info

ID:	447186
PubChem CID:	135281029
Reduced:	F2N3O5C18H21 (1)
Stoich.:	A2B3C5D18E21 (1)
Weight, g/mol:	413.067071
ΔH_f, kcal/mol:	-215.88
Dipole, Da:	6.32
IP(EA), eV:	-9.85(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-methyl-2-oxo-1,3-dioxol-4-yl)methyl 2,2-difluoro-2-[[4-(1,2-oxazol-4-yl)-7-oxo-1,6-diazabicyclo[3.2.1]oct-3-en-6-yl]oxy]acetate

Drug info:

PubChemData

Smile

C1CCCC(CC1)OC(=O)C(ON2C3CN(C2=O)CC(=C3)C4=NC=CO4)(F)F

DOS

IR

Vibrations