Geometry & MOs

Info

ID:	131973
PubChem CID:	51285443
Reduced:	O3N5C17H25 (1)
Stoich.:	A3B5C17D25 (1)
Weight, g/mol:	374.085577
ΔH_f, kcal/mol:	-114.07
Dipole, Da:	7.5
IP(EA), eV:	-8.68(-0.39)
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-[1-(2-methylphenyl)ethyl]acetamide

Drug info:

PubChemData

Smile

CCC1CCC2(CC1)C(=O)N(C(=O)N2)CC(=O)NC3=CC(=NN3C)C

DOS

IR

Vibrations