Geometry & MOs

Info

ID:	279866
PubChem CID:	103845385
Reduced:	N2O3C16H30 (1)
Stoich.:	A2B3C16D30 (1)
Weight, g/mol:	296.184841
ΔH_f, kcal/mol:	-175.51
Dipole, Da:	4.92
IP(EA), eV:	-8.84(1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (3S)-3-methoxy-4-(1H-pyrazol-5-ylmethylamino)pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1C[C@@H](C(C1)NC2CCCCC2)OC

DOS

IR

Vibrations