Geometry & MOs

Info

ID:	413754
PubChem CID:	135086704
Reduced:	BrSN2O2H19C20 (1)
Stoich.:	ABC2D2E19F20 (1)
Weight, g/mol:	341.102749
ΔH_f, kcal/mol:	-25.31
Dipole, Da:	9.28
IP(EA), eV:	-9.15(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-diphenyl-4-(trifluoromethyl)benzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2C3=CN=C(C=C3)Br)C)C

DOS

IR

Vibrations