Geometry & MOs

Info

ID:	291771
PubChem CID:	113479225
Reduced:	N2O3C14H24 (1)
Stoich.:	A2B3C14D24 (1)
Weight, g/mol:	270.088353
ΔH_f, kcal/mol:	-154.31
Dipole, Da:	4.34
IP(EA), eV:	-9.37(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[4-(1-chloropropyl)triazol-1-yl]methyl]-5-(methoxymethyl)-1,2-oxazole

Drug info:

PubChemData

Smile

C1CC(C1)CCNC(=O)N2CCCC(C2)CC(=O)O

DOS

IR

Vibrations