Geometry & MOs

Info

ID:	28070
PubChem CID:	825372
Reduced:	OSN3C8H13 (1)
Stoich.:	ABC3D8E13 (1)
Weight, g/mol:	227.109233
ΔH_f, kcal/mol:	-14.5
Dipole, Da:	5.5
IP(EA), eV:	-9.96(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide

Drug info:

PubChemData

Smile

CC(C)CC1=NN=C(S1)NC(=O)C

DOS

IR

Vibrations