Geometry & MOs

Info

ID:	264776
PubChem CID:	103489727
Reduced:	NOC8H14 (2)
Stoich.:	ABC8D14 (2)
Weight, g/mol:	242.199428
ΔH_f, kcal/mol:	-69.13
Dipole, Da:	4.48
IP(EA), eV:	-9.28(1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1-ethoxypropan-2-yloxy)-2-methyl-2-(propan-2-ylamino)butanenitrile

Drug info:

PubChemData

Smile

CCOCC(C)OCCC1CCCC1(C#N)NC2CC2

DOS

IR

Vibrations