Geometry & MOs

Info

ID:	25994
PubChem CID:	635329
Reduced:	NOC32H55 (1)
Stoich.:	ABC32D55 (1)
Weight, g/mol:	469.370851
ΔH_f, kcal/mol:	-144.71
Dipole, Da:	4.33
IP(EA), eV:	-8.99(1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,5,16-trimethyl-6-(6-methylheptan-2-yl)-16-azahexacyclo[11.11.0.02,10.05,9.015,23.017,22]tetracosa-11,13,15(23),17,19,21-hexaene

Drug info:

PubChemData

Smile

CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC45C3(CCC(C4)(CN(C5)C(=O)C)C)C)C

DOS

IR

Vibrations