Geometry & MOs

Info

ID:	319243
PubChem CID:	126655419
Reduced:	N3C16H19 (1)
Stoich.:	A3B16C19 (1)
Weight, g/mol:	404.200097
ΔH_f, kcal/mol:	80.18
Dipole, Da:	1.98
IP(EA), eV:	-7.95(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-tritylpyrazol-3-yl)pyrrolidine-3-carbonitrile

Drug info:

PubChemData

Smile

C1CC=CCN(C1)C2=NN(C=C2)CC3=CC=CC=C3

DOS

IR

Vibrations