Geometry & MOs

Info

ID:	276130
PubChem CID:	103820791
Reduced:	NO3C17H21 (1)
Stoich.:	AB3C17D21 (1)
Weight, g/mol:	313.179027
ΔH_f, kcal/mol:	-79.11
Dipole, Da:	2.38
IP(EA), eV:	-9.12(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-(quinolin-5-ylamino)pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CCN(CC1=CC=CO1)C(C2=CC=CC=C2)C(=O)OCC

DOS

IR

Vibrations