Geometry & MOs

Info

ID:	186250
PubChem CID:	77411541
Reduced:	FN2O9C42H65 (1)
Stoich.:	AB2C9D42E65 (1)
Weight, g/mol:	384.06847
ΔH_f, kcal/mol:	-511.41
Dipole, Da:	7.46
IP(EA), eV:	-9.36(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

13-bromo-11-butoxy-7-methyl-4-oxa-1,8-diazatricyclo[8.4.0.03,8]tetradeca-10,13-diene-9,12-dione

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCC(C(C(COC1C(C(C(C(O1)CNC(=O)CC2=CC=C(C=C2)C)O)O)O)NC(=O)CC3=CC(=C(C=C3)C)F)O)O

DOS

IR

Vibrations