Geometry & MOs

Info

ID:	183937
PubChem CID:	77091230
Reduced:	N2O3C20H32 (1)
Stoich.:	A2B3C20D32 (1)
Weight, g/mol:	267.137162
ΔH_f, kcal/mol:	-112.6
Dipole, Da:	2.36
IP(EA), eV:	-8.46(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[(5-cyclopropyl-1,2-oxazol-3-yl)methyl-methylamino]methyl]benzonitrile

Drug info:

PubChemData

Smile

CCOC1CCN(CC1)CC2=CC=CC=C2OCCN3CCOCC3

DOS

IR

Vibrations