Geometry & MOs

Info

ID:	303465
PubChem CID:	124489768
Reduced:	NO3C16H25 (1)
Stoich.:	AB3C16D25 (1)
Weight, g/mol:	290.199428
ΔH_f, kcal/mol:	-133.38
Dipole, Da:	1.66
IP(EA), eV:	-8.66(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(1S)-2-phenyl-1-[(3R)-pyrrolidin-3-yl]ethyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)[C@]1(CC=C(C=C1)O)N2CCCCC2

DOS

IR

Vibrations