Geometry & MOs

Info

ID:	398469
PubChem CID:	135033419
Reduced:	OH15C16 (2)
Stoich.:	AB15C16 (2)
Weight, g/mol:	318.219495
ΔH_f, kcal/mol:	23.69
Dipole, Da:	0.91
IP(EA), eV:	-8.64(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,13S)-13-hydroxy-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)C4=CC5=CC=CC=C5O4

DOS

IR

Vibrations