Geometry & MOs

Info

ID:	247200
PubChem CID:	103068685
Reduced:	S2N3C9H15 (1)
Stoich.:	A2B3C9D15 (1)
Weight, g/mol:	241.07074
ΔH_f, kcal/mol:	51.85
Dipole, Da:	3.78
IP(EA), eV:	-8.96(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(3-methyl-1,2,4-thiadiazol-5-yl)sulfanylmethyl]prop-2-enyl]cyclopropanamine

Drug info:

PubChemData

Smile

CCC1=NSC(=N1)SCC(=C)CNC

DOS

IR

Vibrations