Geometry & MOs

Info

ID:	26001
PubChem CID:	635540
Reduced:	O3C32H54 (1)
Stoich.:	A3B32C54 (1)
Weight, g/mol:	487.381415
ΔH_f, kcal/mol:	-225.06
Dipole, Da:	5.24
IP(EA), eV:	-9.37(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,5,20-trimethyl-6-(6-methylheptan-2-yl)-16-azahexacyclo[11.11.0.02,10.05,9.015,23.017,22]tetracosa-15(23),17(22),18,20-tetraen-12-one

Drug info:

PubChemData

Smile

CC(C)CCCC(C)C1CCC2(C1(CC(=O)C3C2CCC4C3(CCCC4(C)C)C)COC(=O)C)C

DOS

IR

Vibrations