Geometry & MOs

Info

ID:	298969
PubChem CID:	117664640
Reduced:	NO5C18H19 (1)
Stoich.:	AB5C18D19 (1)
Weight, g/mol:	302.061966
ΔH_f, kcal/mol:	-137.87
Dipole, Da:	6.37
IP(EA), eV:	-9.19(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-1,2,4-thiadiazol-5-amine;(3-ethyl-1,2,4-thiadiazol-5-yl)carbamic acid

Drug info:

PubChemData

Smile

COC1=CC(=NC=C1)/C=C/C2=C(C(=CC(=C2)OC)OC)C(=O)OC

DOS

IR

Vibrations