Geometry & MOs

Info

ID:	180646
PubChem CID:	76664235
Reduced:	NO2H11C12 (2)
Stoich.:	AB2C11D12 (2)
Weight, g/mol:	221.116427
ΔH_f, kcal/mol:	-90.01
Dipole, Da:	2.23
IP(EA), eV:	-9.36(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(6-methylpyridin-3-yl)methoxy]diazinan-3-one

Drug info:

PubChemData

Smile

CC1=NC2=C(C=C1)C(C3=C(O2)N=C(C=C3)C4=CC=C(C=C4)C(=O)C)C(C)(C)C(=O)O

DOS

IR

Vibrations