Geometry & MOs

Info

ID:	272430
PubChem CID:	103742936
Reduced:	N5C12H17 (1)
Stoich.:	A5B12C17 (1)
Weight, g/mol:	241.124883
ΔH_f, kcal/mol:	85.25
Dipole, Da:	4.04
IP(EA), eV:	-8.79(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-N-[(4-methyloxan-4-yl)methyl]-1,2,4-thiadiazol-5-amine

Drug info:

PubChemData

Smile

CC(C)C1(CC1)CNC2=NC=CN3C2=NN=C3

DOS

IR

Vibrations