Geometry & MOs

Info

ID:	310586
PubChem CID:	126582908
Reduced:	O2S2F3N3H14C15 (1)
Stoich.:	A2B2C3D3E14F15 (1)
Weight, g/mol:	289.088498
ΔH_f, kcal/mol:	-155.41
Dipole, Da:	5.83
IP(EA), eV:	-9.52(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-6-(4-methylphenyl)sulfanyl-5-nitropyridin-2-amine

Drug info:

PubChemData

Smile

C1CC1C2=C(N=C(S2)C3=NC=CS3)C(=O)NCCCC(=O)C(F)(F)F

DOS

IR

Vibrations