Geometry & MOs

Info

ID:	127486
PubChem CID:	51003452
Reduced:	OC20H34 (1)
Stoich.:	AB20C34 (1)
Weight, g/mol:	348.266445
ΔH_f, kcal/mol:	-69.65
Dipole, Da:	1.89
IP(EA), eV:	-8.43(1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R,4R,6R,9Z,11S,12R,15R)-4,9,15-trimethyl-12-propan-2-yl-5-oxatricyclo[9.4.0.04,6]pentadec-9-en-15-yl] acetate

Drug info:

PubChemData

Smile

C/C/1=C\CC/C(=C\[C@@H]2[C@H](CC[C@@]([C@@H]2CC1)(C)O)C(C)C)/C

DOS

IR

Vibrations