Geometry & MOs

Info

ID:	52876
PubChem CID:	14709124
Reduced:	IN2O3H11C18 (1)
Stoich.:	AB2C3D11E18 (1)
Weight, g/mol:	433.991618
ΔH_f, kcal/mol:	-9.35
Dipole, Da:	4.14
IP(EA), eV:	-9.16(-2.12)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(6R)-6-[(S)-benzenesulfonyl(chloro)methyl]-N-hydroxycyclohexa-2,4-dien-1-imine oxide;cyclopenta-1,3-diene;iron

Drug info:

PubChemData

Smile

C1C(=O)NC2=C(N1C3=CC=C(C=C3)I)C(=O)C4=CC=CC=C4C2=O

DOS

IR

Vibrations