Geometry & MOs

Info

ID:	381824
PubChem CID:	134972661
Reduced:	PN2O5C24H41 (1)
Stoich.:	AB2C5D24E41 (1)
Weight, g/mol:	523.247107
ΔH_f, kcal/mol:	-328.36
Dipole, Da:	1.99
IP(EA), eV:	-8.95(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2S)-2-[[1-(2-acetamidonaphthalen-1-yl)naphthalen-2-yl]carbamoyl]pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=CC=C1)NC2(CCCN(C2)C(=O)OC(C)(C)C)P(=O)(OC(C)C)OC(C)C

DOS

IR

Vibrations