Geometry & MOs

Info

ID:	228224
PubChem CID:	87563695
Reduced:	ClSO3N4C17H19 (1)
Stoich.:	ABC3D4E17F19 (1)
Weight, g/mol:	350.09681
ΔH_f, kcal/mol:	-94.59
Dipole, Da:	10.82
IP(EA), eV:	-8.87(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-aminophenyl)carbamothioyl]-4-(dimethylamino)benzamide;hydrochloride

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations