Geometry & MOs

Info

ID:	61822
PubChem CID:	26713500
Reduced:	SN2O5C22H26 (1)
Stoich.:	AB2C5D22E26 (1)
Weight, g/mol:	422.106706
ΔH_f, kcal/mol:	-155.46
Dipole, Da:	7.78
IP(EA), eV:	-8.75(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(E)-3-(3-chloro-4,5-dimethoxyphenyl)prop-2-enoyl]-5-methyl-4-propylthiophene-2-carbohydrazide

Drug info:

PubChemData

Smile

CN(CC1=CC2=C(C=C1)OCCO2)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

DOS

IR

Vibrations