Geometry & MOs

Info

ID:	390102
PubChem CID:	134997093
Reduced:	OSiN5C26H29 (1)
Stoich.:	ABC5D26E29 (1)
Weight, g/mol:	379.214744
ΔH_f, kcal/mol:	58.16
Dipole, Da:	2.96
IP(EA), eV:	-8.92(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2S)-3-methyl-2-[[(Z)-1-(2-methylphenyl)-3-oxo-5-phenylpent-4-enyl]amino]butanoate

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OC1=CC2=C(C=C1)N(C3=CC=CC=C3C=C2)CC4=CN=C(C(=N4)[N+]#[C-])N

DOS

IR

Vibrations