Geometry & MOs

Info

ID:	169563
PubChem CID:	75120620
Reduced:	SN3O3C15H23 (1)
Stoich.:	AB3C3D15E23 (1)
Weight, g/mol:	401.16608
ΔH_f, kcal/mol:	-85.11
Dipole, Da:	3.83
IP(EA), eV:	-8.77(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-thiophen-2-ylcyclopentyl)methyl]-3-(3,4,5-trimethoxyphenyl)prop-2-enamide

Drug info:

PubChemData

Smile

CC1C(C(NN1)C)S(=O)(=O)N2CCOC(C2)C3=CC=CC=C3

DOS

IR

Vibrations