Geometry & MOs

Info

ID:	224642
PubChem CID:	85345537
Reduced:	OC10H15 (2)
Stoich.:	AB10C15 (2)
Weight, g/mol:	302.22458
ΔH_f, kcal/mol:	-59.44
Dipole, Da:	3.46
IP(EA), eV:	-8.99(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

14-hydroxy-1,5,9,16-tetramethyltetracyclo[6.6.2.04,15.012,16]hexadec-4-en-3-one

Drug info:

PubChemData

Smile

CC1=C(C(CCC1)(C)C)C=CC(C)C(C#CC(=CCO)C)O

DOS

IR

Vibrations