Geometry & MOs

Info

ID:	407563
PubChem CID:	135080310
Reduced:	FNOC12H12 (1)
Stoich.:	ABCD12E12 (1)
Weight, g/mol:	242.108899
ΔH_f, kcal/mol:	-77.95
Dipole, Da:	6.1
IP(EA), eV:	-8.94(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethoxyethyl-methyl-(4-methylpyridin-2-yl)imino-lambda4-sulfane

Drug info:

PubChemData

Smile

CC12CCC(=O)N1C3=C(C2)C=CC(=C3)F

DOS

IR

Vibrations