Geometry & MOs

Info

ID:	387549
PubChem CID:	134985804
Reduced:	N2O2C13H18 (1)
Stoich.:	A2B2C13D18 (1)
Weight, g/mol:	221.105193
ΔH_f, kcal/mol:	-32.07
Dipole, Da:	2.39
IP(EA), eV:	-8.72(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methoxyphenyl)-N-(3-oxobutyl)methanimine oxide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations