Geometry & MOs

Info

ID:	430768
PubChem CID:	135170835
Reduced:	FNO2C8H8 (1)
Stoich.:	ABC2D8E8 (1)
Weight, g/mol:	382.050254
ΔH_f, kcal/mol:	-106.83
Dipole, Da:	6.42
IP(EA), eV:	-8.86(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[(5-chloro-2-methoxypyridin-3-yl)sulfanylamino]-3,5-dihydro-2H-pyrido[3,2-f][1,4]oxazepine-4-carboxylic acid

Drug info:

PubChemData

Smile

C1CC2=C(C=C(N2)C(=O)F)OC1

DOS

IR

Vibrations