Geometry & MOs

Info

ID:	195080
PubChem CID:	78632114
Reduced:	SO2N6C20H24 (1)
Stoich.:	AB2C6D20E24 (1)
Weight, g/mol:	333.078327
ΔH_f, kcal/mol:	42.16
Dipole, Da:	9.16
IP(EA), eV:	-9.06(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(furan-2-ylmethyl)-2-[2-[3-(5-methylthiophen-2-yl)prop-2-enoyl]hydrazinyl]-2-oxoacetamide

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1N2C(=NN=C2SCC(=O)C(C#N)C(=N)C)N3CCOCC3

DOS

IR

Vibrations