Geometry & MOs

Info

ID:	277903
PubChem CID:	103831741
Reduced:	ON2C12H24 (1)
Stoich.:	AB2C12D24 (1)
Weight, g/mol:	224.163711
ΔH_f, kcal/mol:	-59.34
Dipole, Da:	3.29
IP(EA), eV:	-9.32(1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-(1,3-dimethylpyrazol-4-yl)hexanamide

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)N(CC)CC1CC1)N

DOS

IR

Vibrations