Geometry & MOs

Info

ID:	336876
PubChem CID:	127255883
Reduced:	BrClFNO2H6C7 (1)
Stoich.:	ABCDE2F6G7 (1)
Weight, g/mol:	397.182168
ΔH_f, kcal/mol:	-138.74
Dipole, Da:	3.01
IP(EA), eV:	-9.55(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7E)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-7-hydroxyiminopyrido[2,3-d][3]benzazepin-6-one

Drug info:

PubChemData

Smile

C1=C(C(=CC(=C1F)Br)N)C(=O)O.Cl

DOS

IR

Vibrations