Geometry & MOs

Info

ID:	404168
PubChem CID:	135065250
Reduced:	FeN2H18C20 (1)
Stoich.:	AB2C18D20 (1)
Weight, g/mol:	270.173213
ΔH_f, kcal/mol:	301.47
Dipole, Da:	16.2
IP(EA), eV:	-6.32(-2.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1'-(2-methoxyphenyl)spiro[adamantane-2,3'-diaziridine]

Drug info:

PubChemData

Smile

CN1C(=CC(=N1)C2=CC=CC=C2)C3=C[CH]C=C3.C1=C[CH]C=C1.[Fe]

DOS

IR

Vibrations