Geometry & MOs

Info

ID:	135266
PubChem CID:	51844253
Reduced:	SN2O5C28H34 (1)
Stoich.:	AB2C5D28E34 (1)
Weight, g/mol:	482.293328
ΔH_f, kcal/mol:	-167.95
Dipole, Da:	9.75
IP(EA), eV:	-9.11(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-tert-butyl-2-(N-[(E)-2,3-diphenylprop-2-enoyl]anilino)-3-ethylpentanamide

Drug info:

PubChemData

Smile

CCCCC(=O)N(CC1=CC=C(O1)C)[C@H](C2=CC=C(C=C2)C)C(=O)NCS(=O)(=O)C3=CC=C(C=C3)C

DOS

IR

Vibrations