Geometry & MOs

Info

ID:	277782
PubChem CID:	103830959
Reduced:	ON4C14H26 (1)
Stoich.:	AB4C14D26 (1)
Weight, g/mol:	290.235814
ΔH_f, kcal/mol:	-47.88
Dipole, Da:	4.36
IP(EA), eV:	-8.95(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-[(4-tert-butylphenyl)methyl]-N-methylhexanamide

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)NCCCN1C(=CC(=N1)C)C)N

DOS

IR

Vibrations