Geometry & MOs

Info

ID:	280859
PubChem CID:	103851646
Reduced:	NC4H7 (4)
Stoich.:	AB4C7 (4)
Weight, g/mol:	308.221226
ΔH_f, kcal/mol:	21.29
Dipole, Da:	3.68
IP(EA), eV:	-8.56(0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-[[(1,3-dimethylpyrazol-4-yl)methylamino]methyl]pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C=NN1C)CNC2CCN(CC2)CC=C(C)C

DOS

IR

Vibrations