Geometry & MOs

Info

ID:	135040
PubChem CID:	51802547
Reduced:	N2O2C29H40 (1)
Stoich.:	A2B2C29D40 (1)
Weight, g/mol:	448.308979
ΔH_f, kcal/mol:	-78.96
Dipole, Da:	6.85
IP(EA), eV:	-9.06(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations