Geometry & MOs

Info

ID:	387244
PubChem CID:	134984553
Reduced:	NO6C12H13 (1)
Stoich.:	AB6C12D13 (1)
Weight, g/mol:	283.193614
ΔH_f, kcal/mol:	-153.23
Dipole, Da:	2.66
IP(EA), eV:	-9.89(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-phenylethyl)-N-phenylmethoxybutan-1-amine

Drug info:

PubChemData

Smile

COC(=O)CC(C(=O)OCC1=CC=CC=C1)[N+](=O)[O-]

DOS

IR

Vibrations