Geometry & MOs

Info

ID:	272388
PubChem CID:	103740799
Reduced:	N3C9H19 (1)
Stoich.:	A3B9C19 (1)
Weight, g/mol:	312.015096
ΔH_f, kcal/mol:	5.7
Dipole, Da:	2.2
IP(EA), eV:	-9.09(1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyano-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-fluorobenzenesulfonamide

Drug info:

PubChemData

Smile

CCC1(CCC1)CNC(=NC)N

DOS

IR

Vibrations