Geometry & MOs

Info

ID:	296632
PubChem CID:	117586312
Reduced:	SN4C6H12 (1)
Stoich.:	AB4C6D12 (1)
Weight, g/mol:	250.088832
ΔH_f, kcal/mol:	53.06
Dipole, Da:	7.72
IP(EA), eV:	-9.26(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-(4-propan-2-yloxyphenyl)thiatriazol-5-amine

Drug info:

PubChemData

Smile

CC(C)(C)N(C)C1=NN=NS1

DOS

IR

Vibrations