Geometry & MOs

Info

ID:	228260
PubChem CID:	87563762
Reduced:	ClSN3O3C20H24 (1)
Stoich.:	ABC3D3E20F24 (1)
Weight, g/mol:	377.132861
ΔH_f, kcal/mol:	-121.69
Dipole, Da:	7.93
IP(EA), eV:	-9.42(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-aminophenyl)carbamothioyl]-4-pentylbenzamide;hydrochloride

Drug info:

PubChemData

Smile

CCCCCC1=CC=C(C=C1)C(=O)NC(=O)N(C2=CC=C(C=C2)C(=O)N)S.Cl

DOS

IR

Vibrations