Geometry & MOs

Info

ID:	277879
PubChem CID:	103831507
Reduced:	NOC7H10 (2)
Stoich.:	ABC7D10 (2)
Weight, g/mol:	228.220164
ΔH_f, kcal/mol:	-71.77
Dipole, Da:	4.06
IP(EA), eV:	-8.56(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-(2-methylpropyl)-N-propan-2-ylhexanamide

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)N1CCOC2=CC=CC=C21)N

DOS

IR

Vibrations