Geometry & MOs

Info

ID:	246349
PubChem CID:	103059336
Reduced:	O3N4C13H14 (1)
Stoich.:	A3B4C13D14 (1)
Weight, g/mol:	256.215078
ΔH_f, kcal/mol:	23.34
Dipole, Da:	5.54
IP(EA), eV:	-8.83(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-3-[[methyl(oxolan-2-ylmethyl)amino]methyl]oxan-4-amine

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)[N+](=O)[O-])OCC2=CN=C(C=N2)NC

DOS

IR

Vibrations