Geometry & MOs

Info

ID:	6102
PubChem CID:	66969
Reduced:	NOC6H11 (1)
Stoich.:	ABC6D11 (1)
Weight, g/mol:	113.084064
ΔH_f, kcal/mol:	-34.71
Dipole, Da:	3.94
IP(EA), eV:	-10.2(1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-propan-2-yloxypropanenitrile

Drug info:

PubChemData

Smile

CC(C)OCCC#N

DOS

IR

Vibrations