Geometry & MOs

Info

ID:	44744
PubChem CID:	10505693
Reduced:	O8H28C29 (1)
Stoich.:	A8B28C29 (1)
Weight, g/mol:	504.204907
ΔH_f, kcal/mol:	-271.06
Dipole, Da:	6.98
IP(EA), eV:	-9.23(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dibenzoyl-N,N'-bis(4-methylphenyl)butanediamide

Drug info:

PubChemData

Smile

C1[C@H]([C@H]([C@@H](C[C@@]1(C(=O)O)OCC2=CC=C(C=C2)C3=CC=CC=C3)OC(=O)/C=C/C4=CC=C(C=C4)O)O)O

DOS

IR

Vibrations