Geometry & MOs

Info

ID:	394485
PubChem CID:	135023094
Reduced:	O3C19H20 (2)
Stoich.:	A3B19C20 (2)
Weight, g/mol:	322.359951
ΔH_f, kcal/mol:	-129.44
Dipole, Da:	5.54
IP(EA), eV:	-9.02(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2,3,4,5,6,7,8,9-nonamethylcyclotetradecane

Drug info:

PubChemData

Smile

CC1=C[C@@]2(C(C([C@@H](C(O2)COCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OC1

DOS

IR

Vibrations