Geometry & MOs

Info

ID:	217349
PubChem CID:	85087667
Reduced:	O2N3H17C22 (1)
Stoich.:	A2B3C17D22 (1)
Weight, g/mol:	355.178358
ΔH_f, kcal/mol:	68.61
Dipole, Da:	3.03
IP(EA), eV:	-9.01(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-1-[2,2-dimethyl-5-(phenylmethoxymethyl)-1,3-dioxolan-4-yl]methanimine oxide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C3=CC=CC=C3N=C2C4=CC=CC(=C4)C=CC(=O)NO

DOS

IR

Vibrations