Geometry & MOs

Info

ID:	247480
PubChem CID:	103071748
Reduced:	O2N3C13H15 (1)
Stoich.:	A2B3C13D15 (1)
Weight, g/mol:	237.111341
ΔH_f, kcal/mol:	-13.91
Dipole, Da:	2.57
IP(EA), eV:	-9.02(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(ethylaminomethyl)prop-2-enyl]-5-nitropyridin-2-one

Drug info:

PubChemData

Smile

CNCC(=C)CN1C(=O)C2=CC=CC=C2C(=O)N1

DOS

IR

Vibrations