Geometry & MOs

Info

ID:	183758
PubChem CID:	77065449
Reduced:	NO2C7H9 (2)
Stoich.:	AB2C7D9 (2)
Weight, g/mol:	227.163377
ΔH_f, kcal/mol:	-134.0
Dipole, Da:	6.24
IP(EA), eV:	-9.02(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(ethylaminomethyl)-2-(oxolan-2-yl)-1,3-diazinan-4-one

Drug info:

PubChemData

Smile

CN(CC1=C(C=CC(=C1)OC)C=CC(=O)O)CC(=O)N

DOS

IR

Vibrations