Geometry & MOs

Info

ID:	424883
PubChem CID:	135124308
Reduced:	NSO2F3C12H14 (1)
Stoich.:	ABC2D3E12F14 (1)
Weight, g/mol:	228.102941
ΔH_f, kcal/mol:	-232.51
Dipole, Da:	7.55
IP(EA), eV:	-10.03(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-7-methyl-2,3,4,5-tetrahydropyrido[2,3-f][1,4]oxazepine;hydrochloride

Drug info:

PubChemData

Smile

CC[C@@H]1CC2=C(C=C(C=C2)C(F)(F)F)S(=O)(=O)NC1

DOS

IR

Vibrations