Geometry & MOs

Info

ID:	277790
PubChem CID:	103830985
Reduced:	NOC5H9 (3)
Stoich.:	ABC5D9 (3)
Weight, g/mol:	238.179361
ΔH_f, kcal/mol:	-151.26
Dipole, Da:	2.71
IP(EA), eV:	-9.13(0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-(2-propan-2-ylpyrazol-3-yl)hexanamide

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)N1CCN(CC1)C(=O)C2CCCO2)N

DOS

IR

Vibrations