Geometry & MOs

Info

ID:	277865
PubChem CID:	103831379
Reduced:	N2O2C17H28 (1)
Stoich.:	A2B2C17D28 (1)
Weight, g/mol:	290.235814
ΔH_f, kcal/mol:	-104.97
Dipole, Da:	3.75
IP(EA), eV:	-9.28(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-[2,4-di(propan-2-yl)phenyl]hexanamide

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)NC(C)C1=CC=CC=C1OC(C)C)N

DOS

IR

Vibrations