Geometry & MOs

Info

ID:	201469
PubChem CID:	79541572
Reduced:	N4C11H20 (1)
Stoich.:	A4B11C20 (1)
Weight, g/mol:	243.173548
ΔH_f, kcal/mol:	26.7
Dipole, Da:	3.47
IP(EA), eV:	-8.09(0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(1-pyrrolidin-2-ylpropan-2-ylamino)methyl]benzonitrile

Drug info:

PubChemData

Smile

CC(CC1CCCN1)NC2=NN(C=C2)C

DOS

IR

Vibrations