Geometry & MOs

Info

ID:	449146
PubChem CID:	135296348
Reduced:	IN3O3C14H22 (1)
Stoich.:	AB3C3D14E22 (1)
Weight, g/mol:	452.288637
ΔH_f, kcal/mol:	-131.6
Dipole, Da:	5.0
IP(EA), eV:	-8.46(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(3-methoxypropoxy)butyl]-5-[2-[4-[3-(5-methyl-1,2-oxazol-3-yl)propoxy]butoxy]ethyl]-1,2-oxazole

Drug info:

PubChemData

Smile

CC1(CCN(CC1)I)CC(=O)N(C=O)C2CCCNC2=O

DOS

IR

Vibrations