Geometry & MOs

Info

ID:	172024
PubChem CID:	75455331
Reduced:	N3O3C18H25 (1)
Stoich.:	A3B3C18D25 (1)
Weight, g/mol:	304.088164
ΔH_f, kcal/mol:	-81.01
Dipole, Da:	1.78
IP(EA), eV:	-8.89(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1-dioxo-N-quinolin-8-ylthiane-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NN(C(=C1CNC(=O)COC2=CC=C(C=C2)C(C)C)OC)C

DOS

IR

Vibrations