Geometry & MOs

Info

ID:	161151
PubChem CID:	57390896
Reduced:	N3O3C28H31 (1)
Stoich.:	A3B3C28D31 (1)
Weight, g/mol:	302.260966
ΔH_f, kcal/mol:	-41.43
Dipole, Da:	6.09
IP(EA), eV:	-8.65(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z,6E,8E)-3,5,7-trimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,6,8-trien-1-ol

Drug info:

PubChemData

Smile

CC1=CN(C=N1)C2=C(C=C(C=C2)/C=C/3\CCCN(C3=O)C4(CCOCC4)C5=CC=CC=C5)OC

DOS

IR

Vibrations