Geometry & MOs

Info

ID:	41453
PubChem CID:	8145910
Reduced:	N2O3C23H32 (1)
Stoich.:	A2B3C23D32 (1)
Weight, g/mol:	381.118735
ΔH_f, kcal/mol:	-9.33
Dipole, Da:	6.5
IP(EA), eV:	-4.21(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-phenyl-N-(4-phenylsulfanylphenyl)benzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1C(C)C)C[NH+]2CC[NH+](CC2)CC3=CC4=C(C=C3)OCO4)O

DOS

IR

Vibrations