Geometry & MOs

Info

ID:	27058
PubChem CID:	814039
Reduced:	N3O3C19H23 (1)
Stoich.:	A3B3C19D23 (1)
Weight, g/mol:	345.114713
ΔH_f, kcal/mol:	-45.27
Dipole, Da:	7.97
IP(EA), eV:	-9.46(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-N-[2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-N-prop-2-enylbenzamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)NC(=O)CN(C(C)C)C(=O)[C@H]2C[C@@H]2C3=CC=CC=C3

DOS

IR

Vibrations