Geometry & MOs

Info

ID:	190123
PubChem CID:	77957786
Reduced:	FN3O5C26H26 (1)
Stoich.:	AB3C5D26E26 (1)
Weight, g/mol:	400.199822
ΔH_f, kcal/mol:	-182.86
Dipole, Da:	3.91
IP(EA), eV:	-8.86(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 6-hydroxy-22,24-dioxa-11,21-diazahexacyclo[12.7.3.01,14.02,11.04,9.015,20]tetracosa-15,17,19-triene-5-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)C(C1=NC(=C(O1)C2=CNC3=C2C=C(C=C3)F)C(=O)OC)NC(=O)OCC4=CC=CC=C4

DOS

IR

Vibrations