Geometry & MOs

Info

ID:	247204
PubChem CID:	103068695
Reduced:	S2N3C9H15 (1)
Stoich.:	A2B3C9D15 (1)
Weight, g/mol:	247.027161
ΔH_f, kcal/mol:	50.09
Dipole, Da:	4.2
IP(EA), eV:	-8.87(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCNCC(=C)CSC1=NC(=NS1)C

DOS

IR

Vibrations