Geometry & MOs

Info

ID:	214121
PubChem CID:	81067390
Reduced:	ClO3N4C13H15 (1)
Stoich.:	AB3C4D13E15 (1)
Weight, g/mol:	272.246378
ΔH_f, kcal/mol:	-45.66
Dipole, Da:	4.31
IP(EA), eV:	-9.24(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine

Drug info:

PubChemData

Smile

CC(CC(=O)O)CN1C(=NN=N1)COC2=CC=C(C=C2)Cl

DOS

IR

Vibrations