Geometry & MOs

Info

ID:	234691
PubChem CID:	92303316
Reduced:	SO2N4C20H26 (1)
Stoich.:	AB2C4D20E26 (1)
Weight, g/mol:	210.093918
ΔH_f, kcal/mol:	-34.25
Dipole, Da:	6.86
IP(EA), eV:	-9.03(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(Z)-[(E)-but-2-enylidene]amino]-3-[(E)-[(Z)-but-2-enylidene]amino]thiourea

Drug info:

PubChemData

Smile

C/C(=N\NC1=NC(=O)[C@H](S1)CC(=O)NCC2=CC=CC=C2)/C3CCCCC3

DOS

IR

Vibrations