Geometry & MOs

Info

ID:	268280
PubChem CID:	103598701
Reduced:	ON4C22H24 (1)
Stoich.:	AB4C22D24 (1)
Weight, g/mol:	369.151098
ΔH_f, kcal/mol:	47.27
Dipole, Da:	4.4
IP(EA), eV:	-8.94(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-3-methyl-4-[3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoylamino]benzamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C2=CC=CC=C2)C)C=CC(=O)N(C3=CN=CC=C3)C(C)C

DOS

IR

Vibrations