Geometry & MOs

Info

ID:	145582
PubChem CID:	53548756
Reduced:	N2O3C17H24 (1)
Stoich.:	A2B3C17D24 (1)
Weight, g/mol:	327.104148
ΔH_f, kcal/mol:	-132.2
Dipole, Da:	1.65
IP(EA), eV:	-8.85(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-2-[3-(3-cyanopropoxy)phenyl]ethenyl]-N-methyl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)N)NC(=O)C1(CCCCC1)C2=CC=C(C=C2)OC

DOS

IR

Vibrations