Geometry & MOs

Info

ID:	211640
PubChem CID:	81044591
Reduced:	ON3C16H31 (1)
Stoich.:	AB3C16D31 (1)
Weight, g/mol:	242.163043
ΔH_f, kcal/mol:	-89.16
Dipole, Da:	3.31
IP(EA), eV:	-8.8(1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-piperidin-3-ylbutanoylamino)propanoic acid

Drug info:

PubChemData

Smile

CCN1CCC(CC1)NC(=O)CC(C)C2CCCNC2

DOS

IR

Vibrations