Geometry & MOs

Info

ID:	223579
PubChem CID:	85335265
Reduced:	FO4N6C21H21 (1)
Stoich.:	AB4C6D21E21 (1)
Weight, g/mol:	440.127817
ΔH_f, kcal/mol:	-49.84
Dipole, Da:	5.43
IP(EA), eV:	-8.19(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(diaminomethylideneamino)-2-[[6-(4-fluorophenoxy)pyridin-3-yl]sulfonylamino]-N-hydroxypentanamide

Drug info:

PubChemData

Smile

C1CN(CCN1C2=C(C=C(C=C2)N3CC(OC3=O)CN=[N+]=[N-])F)C(=O)C=CC4=CC=CO4

DOS

IR

Vibrations