Geometry & MOs

Info

ID:	432769
PubChem CID:	135172906
Reduced:	O3C7H10 (2)
Stoich.:	A3B7C10 (2)
Weight, g/mol:	499.248249
ΔH_f, kcal/mol:	-252.04
Dipole, Da:	6.05
IP(EA), eV:	-10.73(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6S,7R,10S)-7-butyl-10-N-[(4-fluorophenyl)methyl]-6-N-hydroxy-8-oxo-2-oxa-9-azabicyclo[10.2.2]hexadeca-1(14),12,15-triene-6,10-dicarboxamide

Drug info:

PubChemData

Smile

CCCOC(=O)CC(C(C=C)/C=C/C(=O)O)C(=O)OC

DOS

IR

Vibrations