Geometry & MOs

Info

ID:	390048
PubChem CID:	134996807
Reduced:	NSSiO2C15H23 (1)
Stoich.:	ABCD2E15F23 (1)
Weight, g/mol:	239.111028
ΔH_f, kcal/mol:	-99.6
Dipole, Da:	3.51
IP(EA), eV:	-9.56(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11-ethyl-2-fluoro-11H-benzo[c][1]benzazepine

Drug info:

PubChemData

Smile

C[Si](C)(C)CCS(=O)(=O)/N=C/1\CCCC2=CC=CC=C21

DOS

IR

Vibrations