Geometry & MOs

Info

ID:	221997
PubChem CID:	85293263
Reduced:	OSeC26H38 (1)
Stoich.:	ABC26D38 (1)
Weight, g/mol:	445.294057
ΔH_f, kcal/mol:	-47.43
Dipole, Da:	3.42
IP(EA), eV:	-8.05(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[4-methyl-1-[[4-methyl-1-oxo-1-(2-phenylethenylamino)pentan-2-yl]amino]-1-oxopentan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)[Se]CC(C2=CC=CC=C2)O)C(C)(C)C

DOS

IR

Vibrations