Geometry & MOs

Info

ID:	171946
PubChem CID:	75444675
Reduced:	ClNO2H9C10 (2)
Stoich.:	ABC2D9E10 (2)
Weight, g/mol:	266.126657
ΔH_f, kcal/mol:	-101.44
Dipole, Da:	3.68
IP(EA), eV:	-8.79(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,4-dioxaspiro[4.5]decan-3-ylmethyl)-1,2-oxazole-3-carboxamide

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1OC)OC)CC(=O)NC2=NC3=C(C=CC(=C3Cl)Cl)C=C2

DOS

IR

Vibrations