Geometry & MOs

Info

ID:	284817
PubChem CID:	104072312
Reduced:	N3H15C17 (1)
Stoich.:	A3B15C17 (1)
Weight, g/mol:	254.01837
ΔH_f, kcal/mol:	95.24
Dipole, Da:	9.23
IP(EA), eV:	-8.99(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanylmethyl]furan-2-carbaldehyde

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C(C)NC2=CC(=C(C=C2)C#N)C#N

DOS

IR

Vibrations