Geometry & MOs

Info

ID:	159805
PubChem CID:	57288769
Reduced:	F2O3C25H30 (1)
Stoich.:	A2B3C25D30 (1)
Weight, g/mol:	494.206639
ΔH_f, kcal/mol:	-217.32
Dipole, Da:	4.77
IP(EA), eV:	-9.22(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[C-[4-(2-aminoethyl)phenyl]-N-[4-(2-ethyl-1H-imidazol-5-yl)phenyl]carbonimidoyl]-5-nitro-1,3-dihydroindol-2-one

Drug info:

PubChemData

Smile

CCCCCCOC1CCC(CC1)C(=O)OC2=CC(=C(C=C2)C3=CC=C(C=C3)F)F

DOS

IR

Vibrations