Geometry & MOs

Info

ID:	265810
PubChem CID:	103548636
Reduced:	BrO2N3C11H14 (1)
Stoich.:	AB2C3D11E14 (1)
Weight, g/mol:	228.068097
ΔH_f, kcal/mol:	-43.17
Dipole, Da:	5.5
IP(EA), eV:	-9.63(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(morpholin-3-ylmethyl)thiadiazole-4-carboxamide

Drug info:

PubChemData

Smile

C1COCC(N1)CNC(=O)C2=CC(=CN=C2)Br

DOS

IR

Vibrations