Geometry & MOs

Info

ID:	30124
PubChem CID:	840164
Reduced:	NO2H11C12 (1)
Stoich.:	AB2C11D12 (1)
Weight, g/mol:	251.018704
ΔH_f, kcal/mol:	4.41
Dipole, Da:	5.12
IP(EA), eV:	-8.95(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-methyl-1,3,4-thiadiazol-2-yl)-3-thiophen-2-ylprop-2-enamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1)C=CC2=CC=CC=C2O

DOS

IR

Vibrations