Geometry & MOs

Info

ID:	18964
PubChem CID:	551878
Reduced:	OSN2C13H14 (1)
Stoich.:	ABC2D13E14 (1)
Weight, g/mol:	246.082684
ΔH_f, kcal/mol:	0.79
Dipole, Da:	2.59
IP(EA), eV:	-9.06(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

S-(4-methylquinolin-2-yl) N,N-dimethylcarbamothioate

Drug info:

PubChemData

Smile

CC1=CC(=NC2=CC=CC=C12)SC(=O)N(C)C

DOS

IR

Vibrations