Geometry & MOs

Info

ID:	54855
PubChem CID:	17389408
Reduced:	O2C5N5H7 (1)
Stoich.:	A2B5C5D7 (1)
Weight, g/mol:	353.05613
ΔH_f, kcal/mol:	55.46
Dipole, Da:	7.86
IP(EA), eV:	-9.17(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-5-phenyl-6H-1,3,4-thiadiazin-2-amine;hydrobromide

Drug info:

PubChemData

Smile

C1=CN(C=N1)/C(=C(/N)\NO)/N=O

DOS

IR

Vibrations