Geometry & MOs

Info

ID:	448681
PubChem CID:	135292780
Reduced:	N3O5C26H31 (1)
Stoich.:	A3B5C26D31 (1)
Weight, g/mol:	651.652946
ΔH_f, kcal/mol:	-150.07
Dipole, Da:	6.63
IP(EA), eV:	-8.73(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-5-(3-methoxy-3-methylbutoxy)-5-methyl-N-nonacosan-15-yloxyhexan-2-imine

Drug info:

PubChemData

Smile

C/C=C\C=C\1/C(=C/OCC2=CC=C(C=C2)CN3CCOCC3)/CN(C1=O)C4CCC(=O)NC4=O

DOS

IR

Vibrations