Geometry & MOs

Info

ID:	184825
PubChem CID:	77214656
Reduced:	ClN3C9H12 (1)
Stoich.:	AB3C9D12 (1)
Weight, g/mol:	370.174001
ΔH_f, kcal/mol:	39.51
Dipole, Da:	5.55
IP(EA), eV:	-9.05(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 2-[acetamido(propanoyl)amino]-4-hydroxybicyclo[3.1.0]hexane-2,6-dicarboxylate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2C(NNC2Cl)N

DOS

IR

Vibrations