Geometry & MOs

Info

ID:	30200
PubChem CID:	840676
Reduced:	O4N5H9C11 (1)
Stoich.:	A4B5C9D11 (1)
Weight, g/mol:	285.147727
ΔH_f, kcal/mol:	66.35
Dipole, Da:	5.51
IP(EA), eV:	-9.92(-1.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(2-methylanilino)-N-[(5-methylfuran-2-yl)methylideneamino]propanamide

Drug info:

PubChemData

Smile

CC1=NON=C1C(=O)NN=CC2=CC=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations