Geometry & MOs

Info

ID:	256890
PubChem CID:	103142185
Reduced:	N2C15H24 (1)
Stoich.:	A2B15C24 (1)
Weight, g/mol:	181.146664
ΔH_f, kcal/mol:	-2.76
Dipole, Da:	2.0
IP(EA), eV:	-8.6(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-2-[(5-methyloxolan-2-yl)methyl]butanenitrile

Drug info:

PubChemData

Smile

CC(C)CCN(C)C1=CC=CC2=C1CNCC2

DOS

IR

Vibrations