Geometry & MOs

Info

ID:	29361
PubChem CID:	833366
Reduced:	OSN2H14C16 (1)
Stoich.:	ABC2D14E16 (1)
Weight, g/mol:	338.00474
ΔH_f, kcal/mol:	25.81
Dipole, Da:	4.34
IP(EA), eV:	-8.59(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3,4-dichlorophenyl)carbamothioyl]-3-methylbenzamide

Drug info:

PubChemData

Smile

C1CN(C2=CC=CC=C21)C(=S)NC(=O)C3=CC=CC=C3

DOS

IR

Vibrations