Geometry & MOs

Info

ID:	135280
PubChem CID:	51845513
Reduced:	N2O3C29H34 (1)
Stoich.:	A2B3C29D34 (1)
Weight, g/mol:	484.272593
ΔH_f, kcal/mol:	-77.04
Dipole, Da:	3.85
IP(EA), eV:	-9.25(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3S)-N-cyclohexyl-2-(N-[(2S)-2-methoxy-2-phenylacetyl]anilino)-3-phenylbutanamide

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1)[C@H](C(=O)NC(C)(C)C)N(C2=CC=CC=C2)C(=O)[C@H](C3=CC=CC=C3)OC

DOS

IR

Vibrations