Geometry & MOs

Info

ID:	29534
PubChem CID:	834892
Reduced:	NO2C19H23 (1)
Stoich.:	AB2C19D23 (1)
Weight, g/mol:	335.049526
ΔH_f, kcal/mol:	-63.69
Dipole, Da:	3.26
IP(EA), eV:	-8.73(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-2-methoxy-N-[(6-methylpyridin-2-yl)carbamothioyl]benzamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)OCC(=O)NC2=CC=CC=C2C(C)C

DOS

IR

Vibrations