Geometry & MOs

Info

ID:	277881
PubChem CID:	103831539
Reduced:	ON2C14H28 (1)
Stoich.:	AB2C14D28 (1)
Weight, g/mol:	273.15896
ΔH_f, kcal/mol:	-99.34
Dipole, Da:	2.63
IP(EA), eV:	-9.48(1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-[4-(triazol-2-yl)phenyl]hexanamide

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)NC1CCCCC1CC)N

DOS

IR

Vibrations