Geometry & MOs

Info

ID:	263378
PubChem CID:	103360691
Reduced:	S2F3N3C9H14 (1)
Stoich.:	A2B3C3D9E14 (1)
Weight, g/mol:	350.993668
ΔH_f, kcal/mol:	-134.65
Dipole, Da:	5.99
IP(EA), eV:	-8.55(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-N-[(5-chlorothiophen-2-yl)methyl]-4-ethylsulfonyl-5-N-methyl-1,2-thiazole-3,5-diamine

Drug info:

PubChemData

Smile

CC(C)N(CC(F)(F)F)C1=C(C(=NS1)N)SC

DOS

IR

Vibrations