Geometry & MOs

Info

ID:	167372
PubChem CID:	74817108
Reduced:	ClO2N6H21C23 (1)
Stoich.:	AB2C6D21E23 (1)
Weight, g/mol:	260.09277
ΔH_f, kcal/mol:	97.87
Dipole, Da:	4.27
IP(EA), eV:	-9.3(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-(C-chloro-N-hydroxycarbonimidoyl)-3-azabicyclo[3.1.0]hexane-3-carboxylate

Drug info:

PubChemData

Smile

CN1C=CC(=CC1=O)C2=NN=C(N2C)N3CC4CC4C3C5=NOC(=C5)C6=CC(=CC=C6)Cl

DOS

IR

Vibrations