Geometry & MOs

Info

ID:	275028
PubChem CID:	103813251
Reduced:	OSN3C14H23 (1)
Stoich.:	ABC3D14E23 (1)
Weight, g/mol:	221.152812
ΔH_f, kcal/mol:	-21.46
Dipole, Da:	3.2
IP(EA), eV:	-9.04(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-N-(1-pyridin-4-ylethyl)pentanamide

Drug info:

PubChemData

Smile

CN(C)C(CNC(=O)[C@@H]1CCCCN1)C2=CC=CS2

DOS

IR

Vibrations