Geometry & MOs

Info

ID:	150046
PubChem CID:	53789731
Reduced:	NO2H17C18 (1)
Stoich.:	AB2C17D18 (1)
Weight, g/mol:	160.040165
ΔH_f, kcal/mol:	-35.55
Dipole, Da:	5.33
IP(EA), eV:	-8.44(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,3,2-oxazaphospholidin-2-yloxy)propanenitrile

Drug info:

PubChemData

Smile

CC1=CN(C2=C1C=CC(=C2)CC(=O)O)CC3=CC=CC=C3

DOS

IR

Vibrations