Geometry & MOs

Info

ID:	134906
PubChem CID:	51780166
Reduced:	N2O2C27H34 (1)
Stoich.:	A2B2C27D34 (1)
Weight, g/mol:	390.251858
ΔH_f, kcal/mol:	-81.25
Dipole, Da:	1.11
IP(EA), eV:	-8.7(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-2-(cyclohexylamino)-1-(4-hydroxy-3-methoxyphenyl)-2-oxoethyl]-N-methylhexanamide

Drug info:

PubChemData

Smile

CCCCCC(=O)N(C)[C@@H](C1=CC2=CC=CC=C2C3=CC=CC=C31)C(=O)NC(C)(C)C

DOS

IR

Vibrations