Geometry & MOs

Info

ID:	379916
PubChem CID:	134964213
Reduced:	N2C7H9 (2)
Stoich.:	A2B7C9 (2)
Weight, g/mol:	163.110947
ΔH_f, kcal/mol:	63.36
Dipole, Da:	1.89
IP(EA), eV:	-8.88(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1-methylpyrazol-4-yl)pentanenitrile

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CN=C(N)NCCC2=CNC=C2

DOS

IR

Vibrations