Geometry & MOs

Info

ID:	444562
PubChem CID:	135262856
Reduced:	N2O2C14H15 (2)
Stoich.:	A2B2C14D15 (2)
Weight, g/mol:	486.101621
ΔH_f, kcal/mol:	-31.58
Dipole, Da:	3.33
IP(EA), eV:	-8.09(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-chlorofuran-2-yl)-(2,4-dimethylphenyl)methyl]-1-(2,2-dioxo-1H-4,2lambda6,1-benzoxathiazin-6-yl)cyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(C2=CC=C(O2)C)NC(=O)CC3=CC4=C(C(=O)N=C4C=C3)NO)N5CCCCC5

DOS

IR

Vibrations