Geometry & MOs

Info

ID:	247201
PubChem CID:	103068689
Reduced:	S2N3C10H15 (1)
Stoich.:	A2B3C10D15 (1)
Weight, g/mol:	215.05509
ΔH_f, kcal/mol:	72.99
Dipole, Da:	3.65
IP(EA), eV:	-8.96(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NSC(=N1)SCC(=C)CNC2CC2

DOS

IR

Vibrations