Geometry & MOs

Info

ID:	247202
PubChem CID:	103068691
Reduced:	S2N3C8H13 (1)
Stoich.:	A2B3C8D13 (1)
Weight, g/mol:	201.03944
ΔH_f, kcal/mol:	55.67
Dipole, Da:	4.08
IP(EA), eV:	-8.93(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-methyl-1,2,4-thiadiazol-5-yl)sulfanylmethyl]prop-2-en-1-amine

Drug info:

PubChemData

Smile

CC1=NSC(=N1)SCC(=C)CNC

DOS

IR

Vibrations