Geometry & MOs

Info

ID:	272242
PubChem CID:	103736541
Reduced:	SN3C10H15 (1)
Stoich.:	AB3C10D15 (1)
Weight, g/mol:	257.10204
ΔH_f, kcal/mol:	67.71
Dipole, Da:	3.82
IP(EA), eV:	-8.96(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methylsulfanylcyclopentyl)-3-propan-2-yl-1,2,4-thiadiazol-5-amine

Drug info:

PubChemData

Smile

CCC1CC1NC2=NC(=NS2)C3CC3

DOS

IR

Vibrations