Geometry & MOs

Info

ID:	309707
PubChem CID:	126555573
Reduced:	OSN4C16H28 (1)
Stoich.:	ABC4D16E28 (1)
Weight, g/mol:	376.172168
ΔH_f, kcal/mol:	-3.07
Dipole, Da:	7.17
IP(EA), eV:	-8.08(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(E)-1,2-dihydroindol-3-ylidenemethyl]-4-(4-ethenylphenyl)piperazine-1-carbothioamide

Drug info:

PubChemData

Smile

CCC/C(=C\N=C\1COCC/C1=N/NC(=S)N(CC)CC)/C

DOS

IR

Vibrations