Geometry & MOs

Info

ID:	398069
PubChem CID:	135031621
Reduced:	N2O2H22C25 (1)
Stoich.:	A2B2C22D25 (1)
Weight, g/mol:	314.126657
ΔH_f, kcal/mol:	58.4
Dipole, Da:	1.7
IP(EA), eV:	-8.46(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2S,5S)-2-hydroxy-6-oxo-1,7-diazatetracyclo[8.6.1.05,17.011,16]heptadeca-10(17),11,13,15-tetraene-5-carboxylate

Drug info:

PubChemData

Smile

C1=CC(=C(NC2=CC=C(C=C2)CC3=CC=C(C=C3)NC(=C4C=CC=C4)O)O)C=C1

DOS

IR

Vibrations