Geometry & MOs

Info

ID:	53814
PubChem CID:	14718029
Reduced:	N2O8C11H13 (1)
Stoich.:	A2B8C11D13 (1)
Weight, g/mol:	225.115364
ΔH_f, kcal/mol:	-245.92
Dipole, Da:	2.93
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.803043
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(phenylmethoxymethyl)phenyl]methanimine

Drug info:

PubChemData

Smile

CC(=O)NC(CC(=O)[O-])C(=O)NC(CCC(=O)[O-])C(=O)[O-]

DOS

IR

Vibrations