Geometry & MOs

Info

ID:	44387
PubChem CID:	10503316
Reduced:	NO3C29H31 (1)
Stoich.:	AB3C29D31 (1)
Weight, g/mol:	441.230394
ΔH_f, kcal/mol:	-68.45
Dipole, Da:	2.47
IP(EA), eV:	-8.97(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (E)-2-methyl-3-[5-[2-[methyl(2-phenylethyl)amino]-2-oxoethyl]-2-phenylphenyl]prop-2-enoate

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)CC[C@H](C(=O)OC)NC1(C2=CC=CC=C2C3=CC=CC=C31)C4=CC=CC=C4

DOS

IR

Vibrations