Geometry & MOs

Info

ID:	398670
PubChem CID:	135034679
Reduced:	ON2H22C24 (1)
Stoich.:	AB2C22D24 (1)
Weight, g/mol:	320.235145
ΔH_f, kcal/mol:	32.08
Dipole, Da:	3.2
IP(EA), eV:	-8.74(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,3R,4R,7R,9R,10S,13S)-7,10,15-trimethyl-4-propan-2-yl-14,16-dioxapentacyclo[8.4.2.01,9.03,7.013,15]hexadecan-4-ol

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)N2[C@H]3C4=CC=CC=C4CCN3[C@@H](C2=O)C5=CC=CC=C5

DOS

IR

Vibrations