Geometry & MOs

Info

ID:	135038
PubChem CID:	51802412
Reduced:	NOC17H20 (2)
Stoich.:	ABC17D20 (2)
Weight, g/mol:	448.308979
ΔH_f, kcal/mol:	-40.26
Dipole, Da:	4.08
IP(EA), eV:	-9.1(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-tert-butyl-2-[[(Z)-2,3-diphenylprop-2-enoyl]-propylamino]-3-ethylpentanamide

Drug info:

PubChemData

Smile

CCCN([C@H](C1=C(C=C(C=C1)C)C)C(=O)NC2CCCCC2)C(=O)/C(=C/C3=CC=CC=C3)/C4=CC=CC=C4

DOS

IR

Vibrations