Geometry & MOs

Info

ID:	277848
PubChem CID:	103831259
Reduced:	ON4C10H18 (1)
Stoich.:	AB4C10D18 (1)
Weight, g/mol:	272.163711
ΔH_f, kcal/mol:	-17.27
Dipole, Da:	6.12
IP(EA), eV:	-8.81(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-(3-pyrazol-1-ylphenyl)hexanamide

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)NC1=CC=NN1C)N

DOS

IR

Vibrations