Geometry & MOs

Info

ID:	208967
PubChem CID:	80607901
Reduced:	SO2N5C9H13 (1)
Stoich.:	AB2C5D9E13 (1)
Weight, g/mol:	245.119798
ΔH_f, kcal/mol:	-35.69
Dipole, Da:	6.01
IP(EA), eV:	-8.84(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-methoxypropoxymethyl)-N-propyl-1,3,4-thiadiazol-2-amine

Drug info:

PubChemData

Smile

CCNC1=NN=C(S1)CN2C(=O)CN(C2=O)C

DOS

IR

Vibrations