Geometry & MOs

Info

ID:	51683
PubChem CID:	12014397
Reduced:	SN2H9C10 (2)
Stoich.:	AB2C9D10 (2)
Weight, g/mol:	528.169391
ΔH_f, kcal/mol:	106.6
Dipole, Da:	9.66
IP(EA), eV:	-8.39(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,2-diphenyl-N-[4-(N-(2-phenylethanethioyl)anilino)phenyl]ethanethioamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N(C2=CC=C(C=C2)N(C3=CC=CC=C3)C(=S)N)C(=S)N

DOS

IR

Vibrations