Geometry & MOs

Info

ID:	218543
PubChem CID:	85089598
Reduced:	NO3C13H21 (2)
Stoich.:	AB3C13D21 (2)
Weight, g/mol:	478.283158
ΔH_f, kcal/mol:	-304.47
Dipole, Da:	2.82
IP(EA), eV:	-8.25(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11-ethyl-10-methyl-21,26-diazapentacyclo[23.2.1.05,16.07,15.08,12]octacosa-3,13,18-triene-2,20,27,28-tetrone

Drug info:

PubChemData

Smile

CC(C)(C)C(C(=O)NC)NC(=O)C(CCCCOC1=CC=C(C=C1)OC)CC(=O)OC(C)(C)C

DOS

IR

Vibrations