Geometry & MOs

Info

ID:	300169
PubChem CID:	121147435
Reduced:	SO2N3H13C16 (1)
Stoich.:	AB2C3D13E16 (1)
Weight, g/mol:	371.093977
ΔH_f, kcal/mol:	38.45
Dipole, Da:	6.5
IP(EA), eV:	-8.93(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(3,4-dimethoxyphenyl)-N-[3-(3-methyl-1,2,4-oxadiazol-5-yl)thiophen-2-yl]prop-2-enamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)C2=C(SC=C2)NC(=O)/C=C/C3=CC=CC=C3

DOS

IR

Vibrations