Geometry & MOs

Info

ID:	252905
PubChem CID:	103114873
Reduced:	N2O2C13H16 (1)
Stoich.:	A2B2C13D16 (1)
Weight, g/mol:	278.13789
ΔH_f, kcal/mol:	56.38
Dipole, Da:	6.8
IP(EA), eV:	-9.51(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[(2-methyl-3-nitrophenyl)methylamino]ethyl]imidazolidin-2-one

Drug info:

PubChemData

Smile

CCC(C#C)NCC1=C(C(=CC=C1)[N+](=O)[O-])C

DOS

IR

Vibrations