Geometry & MOs

Info

ID:	449442
PubChem CID:	135298630
Reduced:	FSN2O4C17H19 (1)
Stoich.:	ABC2D4E17F19 (1)
Weight, g/mol:	305.141579
ΔH_f, kcal/mol:	-146.82
Dipole, Da:	3.87
IP(EA), eV:	-9.13(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,17-dimethyl-4-oxo-11-azatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),7(12),8,10,13,15-hexaen-6-yl)acetaldehyde

Drug info:

PubChemData

Smile

CCCCOC1=CC=CC(=C1)C(=O)NNS(=O)(=O)C2=CC=CC=C2F

DOS

IR

Vibrations