Geometry & MOs

Info

ID:	209041
PubChem CID:	80616306
Reduced:	OSN4C14H24 (1)
Stoich.:	ABC4D14E24 (1)
Weight, g/mol:	273.974981
ΔH_f, kcal/mol:	-24.4
Dipole, Da:	2.69
IP(EA), eV:	-8.86(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-N-[(5-chlorothiophen-2-yl)methyl]-1,3,4-thiadiazole-2-carboxamide

Drug info:

PubChemData

Smile

CCCNC1=NN=C(S1)C(=O)N(C)C2CCC(CC2)C

DOS

IR

Vibrations