Geometry & MOs

Info

ID:	255606
PubChem CID:	103133350
Reduced:	O2N3C10H11 (1)
Stoich.:	A2B3C10D11 (1)
Weight, g/mol:	355.11469
ΔH_f, kcal/mol:	9.66
Dipole, Da:	7.0
IP(EA), eV:	-9.36(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-bromo-5-[(5-methyloxolan-2-yl)methoxy]phenyl]methyl]-2-methylpropan-1-amine

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C(=O)C2=CC=C(O2)CN

DOS

IR

Vibrations