Geometry & MOs

Info

ID:	393728
PubChem CID:	135021568
Reduced:	NO2H16C20 (2)
Stoich.:	AB2C16D20 (2)
Weight, g/mol:	218.118104
ΔH_f, kcal/mol:	112.25
Dipole, Da:	1.11
IP(EA), eV:	-9.29(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

benzyl 1-azoniabicyclo[3.1.0]hexane-1-carboxylate

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C(=C1C3=CC=C(C=C3)C4=C(C5=CC=CC=C5C4(C)C)C6=CC=C(C=C6)[N+](=O)[O-])C7=CC=C(C=C7)[N+](=O)[O-])C

DOS

IR

Vibrations