Geometry & MOs

Info

ID:	339145
PubChem CID:	127260524
Reduced:	NO3C16H21 (1)
Stoich.:	AB3C16D21 (1)
Weight, g/mol:	345.136493
ΔH_f, kcal/mol:	-116.36
Dipole, Da:	5.27
IP(EA), eV:	-9.43(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzoyl (2S)-4-naphthalen-1-ylpyrrolidine-2-carboxylate

Drug info:

PubChemData

Smile

CCC(C)C1C[C@H](NC1)C(=O)OC(=O)C2=CC=CC=C2

DOS

IR

Vibrations