Geometry & MOs

Info

ID:	391235
PubChem CID:	135003726
Reduced:	ISSeH13C15 (1)
Stoich.:	ABCD13E15 (1)
Weight, g/mol:	428.209993
ΔH_f, kcal/mol:	84.28
Dipole, Da:	1.12
IP(EA), eV:	-8.36(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-[[(E)-2-oxo-1,4-diphenylbut-3-enyl]amino]phenyl]carbamate

Drug info:

PubChemData

Smile

CS/C(=C(/C1=CC=CC=C1)\[Se]C2=CC=CC=C2)/I

DOS

IR

Vibrations