Geometry & MOs

Info

ID:	176751
PubChem CID:	76093643
Reduced:	O3N5C31H39 (1)
Stoich.:	A3B5C31D39 (1)
Weight, g/mol:	398.172939
ΔH_f, kcal/mol:	-60.8
Dipole, Da:	4.13
IP(EA), eV:	-8.89(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-hydroxy-3-methyl-2,8-bis(phenylmethoxy)-1,4-dioxaspiro[4.4]nonane-3-carbaldehyde

Drug info:

PubChemData

Smile

CCN(CCCC(C(=O)N)N(C(C)C1=CC=C(C=C1)OC)C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C(=N)N

DOS

IR

Vibrations