Geometry & MOs

Info

ID:	172508
PubChem CID:	75518901
Reduced:	O2S3N4C9H12 (1)
Stoich.:	A2B3C4D9E12 (1)
Weight, g/mol:	311.076219
ΔH_f, kcal/mol:	1.05
Dipole, Da:	1.18
IP(EA), eV:	-8.98(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-3-[(2-methylphenyl)methylsulfonylmethyl]-1,2,4-thiadiazol-5-amine

Drug info:

PubChemData

Smile

CC1=CSC(=N1)S(=O)(=O)CC2=NSC(=N2)N(C)C

DOS

IR

Vibrations