Geometry & MOs

Info

ID:	29368
PubChem CID:	833393
Reduced:	SN2O3H16C17 (1)
Stoich.:	AB2C3D16E17 (1)
Weight, g/mol:	327.104148
ΔH_f, kcal/mol:	-59.78
Dipole, Da:	5.98
IP(EA), eV:	-9.03(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-phenylpropanoylcarbamothioylamino)benzamide

Drug info:

PubChemData

Smile

CC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)COC2=CC=CC=C2

DOS

IR

Vibrations