Geometry & MOs

Info

ID:	247203
PubChem CID:	103068694
Reduced:	S2N3C7H11 (1)
Stoich.:	A2B3C7D11 (1)
Weight, g/mol:	229.07074
ΔH_f, kcal/mol:	57.29
Dipole, Da:	2.96
IP(EA), eV:	-9.04(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations