Geometry & MOs

Info

ID:	449696
PubChem CID:	135300698
Reduced:	NO2C12H23 (1)
Stoich.:	AB2C12D23 (1)
Weight, g/mol:	470.167065
ΔH_f, kcal/mol:	-83.38
Dipole, Da:	1.93
IP(EA), eV:	-8.9(1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

nonacyclo[12.12.9.127,31.01,14.02,7.08,13.015,20.021,26.035,36]hexatriaconta-2,4,6,8,10,12,15,17,19,21,23,25,27,29,31(36),32,34-heptadecaen-28-ol

Drug info:

PubChemData

Smile

CC(C)COC1=CC(N(C1(C)C)O)(C)C

DOS

IR

Vibrations