Geometry & MOs

Info

ID:	238839
PubChem CID:	93165587
Reduced:	N2O3C17H32 (1)
Stoich.:	A2B3C17D32 (1)
Weight, g/mol:	312.241293
ΔH_f, kcal/mol:	-187.5
Dipole, Da:	7.17
IP(EA), eV:	-9.14(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3S)-2-[[2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-2-methylpropanoyl]amino]-3-methylpentanoic acid

Drug info:

PubChemData

Smile

CC[C@@H](C)[C@@H](C(=O)O)NC(=O)C(C)(C)N1[C@@H](CCC[C@@H]1C)C

DOS

IR

Vibrations