Geometry & MOs

Info

ID:	209065
PubChem CID:	80618972
Reduced:	OSN5C14H25 (1)
Stoich.:	ABC5D14E25 (1)
Weight, g/mol:	310.089975
ΔH_f, kcal/mol:	-9.32
Dipole, Da:	2.52
IP(EA), eV:	-8.4(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-fluoro-2-methoxyphenyl)-5-(propylamino)-1,3,4-thiadiazole-2-carboxamide

Drug info:

PubChemData

Smile

CCCNC1=NN=C(S1)C(=O)N(C)C2CCN(CC2)CC

DOS

IR

Vibrations