Geometry & MOs

Info

ID:	55549
PubChem CID:	17395529
Reduced:	OSN2H12C13 (1)
Stoich.:	ABC2D12E13 (1)
Weight, g/mol:	365.086784
ΔH_f, kcal/mol:	16.74
Dipole, Da:	5.53
IP(EA), eV:	-9.14(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]-N-(1,3-thiazol-2-yl)butanamide

Drug info:

PubChemData

Smile

C1CC2=C(C1)C=C(C=C2)C(=O)NC3=NC=CS3

DOS

IR

Vibrations