Geometry & MOs

Info

ID:	170148
PubChem CID:	75204665
Reduced:	N2O5C23H26 (1)
Stoich.:	A2B5C23D26 (1)
Weight, g/mol:	428.130697
ΔH_f, kcal/mol:	-144.69
Dipole, Da:	5.94
IP(EA), eV:	-8.56(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-4-[3-(4-imidazo[2,1-b][1,3]thiazol-6-ylanilino)-3-oxoprop-1-enyl]benzamide

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1NC(=O)CN(C)C(=O)C=CC2=CC3=C(C(=C2)OC)OCCO3

DOS

IR

Vibrations