Geometry & MOs

Info

ID:	60894
PubChem CID:	26702917
Reduced:	NS2O3H19C23 (1)
Stoich.:	AB2C3D19E23 (1)
Weight, g/mol:	349.088498
ΔH_f, kcal/mol:	-27.86
Dipole, Da:	6.29
IP(EA), eV:	-8.29(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-(2-methyl-1,3-benzoxazol-5-yl)-4-phenyl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C=C2C(=C1)C3=CC=CC=C3O2)NC(=O)C4=CC=C(C=C4)C5SCCS5

DOS

IR

Vibrations