Geometry & MOs

Info

ID:	222289
PubChem CID:	85296303
Reduced:	ON2C21H26 (1)
Stoich.:	AB2C21D26 (1)
Weight, g/mol:	322.250795
ΔH_f, kcal/mol:	16.19
Dipole, Da:	3.3
IP(EA), eV:	-9.02(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-hydroxy-2',4,4,7,8a-pentamethylspiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,5'-oxolane]-2'-yl)acetaldehyde

Drug info:

PubChemData

Smile

CCC(C1=CC=C(C=C1)C)(C(C)C=C)NNC(=O)C2=CC=CC=C2

DOS

IR

Vibrations