Geometry & MOs

Info

ID:	135272
PubChem CID:	51845066
Reduced:	NOC13H20 (2)
Stoich.:	ABC13D20 (2)
Weight, g/mol:	398.293328
ΔH_f, kcal/mol:	-114.49
Dipole, Da:	4.66
IP(EA), eV:	-9.25(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-1-cyclohexyl-2-(cyclohexylamino)-2-oxoethyl]-3-methyl-N-phenylbutanamide

Drug info:

PubChemData

Smile

C/C=C\[C@H](C(=O)NC(C)(C)CC(C)(C)C)N(C1=CC=CC=C1)C(=O)C2CCCCC2

DOS

IR

Vibrations