Geometry & MOs

Info

ID:	256560
PubChem CID:	103139899
Reduced:	N2O2C13H16 (1)
Stoich.:	A2B2C13D16 (1)
Weight, g/mol:	311.08848
ΔH_f, kcal/mol:	-37.11
Dipole, Da:	4.37
IP(EA), eV:	-8.03(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-2-bromo-N-[(5-methyloxolan-2-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

COCCCOC1=C2C=NC=CC2=C(C=C1)N

DOS

IR

Vibrations