Geometry & MOs

Info

ID:	261826
PubChem CID:	103253426
Reduced:	NO3C17H25 (1)
Stoich.:	AB3C17D25 (1)
Weight, g/mol:	272.173607
ΔH_f, kcal/mol:	-141.61
Dipole, Da:	5.72
IP(EA), eV:	-9.28(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(1-methoxybutan-2-ylamino)acetyl]piperidine-4-carboxylic acid

Drug info:

PubChemData

Smile

CCC1CCC(CC1)(CNC(C2=CC=CC=C2)C(=O)O)O

DOS

IR

Vibrations