Geometry & MOs

Info

ID:	131622
PubChem CID:	51236214
Reduced:	SO2N5H19C20 (1)
Stoich.:	AB2C5D19E20 (1)
Weight, g/mol:	342.115047
ΔH_f, kcal/mol:	8.34
Dipole, Da:	7.5
IP(EA), eV:	-8.54(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-methyl-1,2-oxazol-3-yl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylpropanamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC2=C(C=C1)NC(=O)N2)SC3=NC4=CC=CC=C4N3CC=C

DOS

IR

Vibrations