Geometry & MOs

Info

ID:	70532
PubChem CID:	48413478
Reduced:	FON3C20H28 (1)
Stoich.:	ABC3D20E28 (1)
Weight, g/mol:	397.159076
ΔH_f, kcal/mol:	-78.89
Dipole, Da:	4.4
IP(EA), eV:	-8.7(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-chloro-3-oxo-4H-1,4-benzothiazin-2-yl)-N-[5-(diethylamino)pentan-2-yl]acetamide

Drug info:

PubChemData

Smile

CCN(CC)CCCC(C)NC(=O)C1=C(N=C2C=C(C=CC2=C1)F)C

DOS

IR

Vibrations