Geometry & MOs

Info

ID:	216187
PubChem CID:	85085855
Reduced:	NSiO2C12H21 (1)
Stoich.:	ABC2D12E21 (1)
Weight, g/mol:	239.08254
ΔH_f, kcal/mol:	-127.99
Dipole, Da:	4.51
IP(EA), eV:	-9.28(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10-(methylamino)-1,3-diazatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-2-one;hydrochloride

Drug info:

PubChemData

Smile

CC(=C(C#N)C(=O)C)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations