Geometry & MOs

Info

ID:	267215
PubChem CID:	103581371
Reduced:	BrN2O3C13H17 (1)
Stoich.:	AB2C3D13E17 (1)
Weight, g/mol:	259.193614
ΔH_f, kcal/mol:	-36.54
Dipole, Da:	6.2
IP(EA), eV:	-9.61(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)oxolan-3-amine

Drug info:

PubChemData

Smile

CC1C(CCO1)(C)NCC2=C(C=C(C=C2)[N+](=O)[O-])Br

DOS

IR

Vibrations