Geometry & MOs

Info

ID:	135044
PubChem CID:	51804055
Reduced:	N2O3C26H36 (1)
Stoich.:	A2B3C26D36 (1)
Weight, g/mol:	450.288243
ΔH_f, kcal/mol:	-120.89
Dipole, Da:	3.8
IP(EA), eV:	-9.2(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations