Geometry & MOs

Info

ID:	49068
PubChem CID:	11528674
Reduced:	N3H13C14 (1)
Stoich.:	A3B13C14 (1)
Weight, g/mol:	223.110947
ΔH_f, kcal/mol:	74.01
Dipole, Da:	2.7
IP(EA), eV:	-8.32(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-2-(6-phenylpyridazin-3-yl)propanenitrile

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2=CC3=C(C=C2)C(=NN3)N

DOS

IR

Vibrations