Geometry & MOs

Info

ID:	182777
PubChem CID:	76937456
Reduced:	NO2C7H7 (2)
Stoich.:	AB2C7D7 (2)
Weight, g/mol:	274.067051
ΔH_f, kcal/mol:	-72.75
Dipole, Da:	8.88
IP(EA), eV:	-9.5(-2.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-hydrazinylthiadiazol-4-yl)methylsulfanyl]-6-methyl-1,3-diazinan-4-one

Drug info:

PubChemData

Smile

C1CCOC(C1)C(C2=CC3=NC(=O)C(=O)N=C3C=C2)O

DOS

IR

Vibrations