Geometry & MOs

Info

ID:	51682
PubChem CID:	12014396
Reduced:	NSH25C34 (1)
Stoich.:	ABC25D34 (1)
Weight, g/mol:	378.097289
ΔH_f, kcal/mol:	155.13
Dipole, Da:	0.34
IP(EA), eV:	-8.03(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(N-carbamothioylanilino)phenyl]-1-phenylthiourea

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C(SC(=C2C3=CC=CC=C3)N(C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

DOS

IR

Vibrations