Geometry & MOs

Info

ID:	238914
PubChem CID:	93165724
Reduced:	N2O3C18H26 (1)
Stoich.:	A2B3C18D26 (1)
Weight, g/mol:	318.194343
ΔH_f, kcal/mol:	-132.43
Dipole, Da:	5.99
IP(EA), eV:	-9.61(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3S)-3-methyl-2-[[(2R)-2-phenyl-2-pyrrolidin-1-ylacetyl]amino]pentanoic acid

Drug info:

PubChemData

Smile

CC[C@@H](C)[C@H](C(=O)O)NC(=O)[C@@H](C1=CC=CC=C1)N2CCCC2

DOS

IR

Vibrations