Geometry & MOs

Info

ID:	47986
PubChem CID:	10536181
Reduced:	N2O2C11H12 (1)
Stoich.:	A2B2C11D12 (1)
Weight, g/mol:	204.089878
ΔH_f, kcal/mol:	-40.71
Dipole, Da:	3.92
IP(EA), eV:	-9.12(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-aminoethylamino)chromen-4-one

Drug info:

PubChemData

Smile

COC(=O)CCN1C=NC2=CC=CC=C21

DOS

IR

Vibrations