Geometry & MOs

Info

ID:	147637
PubChem CID:	53787293
Reduced:	PN2O5C15H21 (1)
Stoich.:	AB2C5D15E21 (1)
Weight, g/mol:	561.262105
ΔH_f, kcal/mol:	-261.1
Dipole, Da:	7.39
IP(EA), eV:	-9.54(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-1-[(2S)-5-(diaminomethylideneamino)-2-[(7-methoxynaphthalen-2-yl)sulfonylamino]pentanoyl]piperidine-2-carboxylic acid

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N1CCC[C@H]1C(=O)O)NP(=O)(CC2=CC=CC=C2)O

DOS

IR

Vibrations