Geometry & MOs

Info

ID:	131025
PubChem CID:	51147101
Reduced:	N3O4H17C20 (1)
Stoich.:	A3B4C17D20 (1)
Weight, g/mol:	356.122835
ΔH_f, kcal/mol:	-109.75
Dipole, Da:	10.09
IP(EA), eV:	-9.27(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]-N-propan-2-ylbutanamide

Drug info:

PubChemData

Smile

CN1C(=O)C2=C(C1=O)C=C(C=C2)NC(=O)C3=CC=C(C=C3)N4CCCC4=O

DOS

IR

Vibrations