Geometry & MOs

Info

ID:	31584
PubChem CID:	855902
Reduced:	OSN2C16H16 (1)
Stoich.:	ABC2D16E16 (1)
Weight, g/mol:	335.098
ΔH_f, kcal/mol:	44.17
Dipole, Da:	4.55
IP(EA), eV:	-9.1(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-benzoyl-4,5-dimethylthiophen-2-yl)benzamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(O2)C3=CC=CS3

DOS

IR

Vibrations