Geometry & MOs

Info

ID:	191529
PubChem CID:	78159214
Reduced:	F3N4O8C22H27 (1)
Stoich.:	A3B4C8D22E27 (1)
Weight, g/mol:	363.084869
ΔH_f, kcal/mol:	-471.59
Dipole, Da:	7.43
IP(EA), eV:	-10.09(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[[(2-aminocyclopropanecarbonyl)amino]carbamoyl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate

Drug info:

PubChemData

Smile

CC(=O)NC1C(C=C(OC1C(C(CO)O)O)C(=O)O)N=C(N)NC(=O)CCC2=CC=CC=C2C(F)(F)F

DOS

IR

Vibrations