Geometry & MOs

Info

ID:	255571
PubChem CID:	103133064
Reduced:	N2O2C15H16 (1)
Stoich.:	A2B2C15D16 (1)
Weight, g/mol:	355.11469
ΔH_f, kcal/mol:	-21.48
Dipole, Da:	6.17
IP(EA), eV:	-9.57(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-bromo-4-[(5-methyloxolan-2-yl)methoxy]phenyl]methyl]-2-methylpropan-1-amine

Drug info:

PubChemData

Smile

CNC1COCC1C(=O)C2=CC=CC3=C2C=NC=C3

DOS

IR

Vibrations