Geometry & MOs

Info

ID:	402962
PubChem CID:	135058082
Reduced:	SO2N6H26C31 (1)
Stoich.:	AB2C6D26E31 (1)
Weight, g/mol:	527.220892
ΔH_f, kcal/mol:	93.49
Dipole, Da:	6.88
IP(EA), eV:	-8.64(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-methoxy-5,5-dimethyl-1,3,4-oxadiazol-2-yl)oxy]-2,3,4,5-tetraphenylcyclopenta-2,4-dien-1-imine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NN(C3(N2C4=CC=CC=C4)N(N=C(S3)C(=O)NC5=CC=CC=C5)C6=CC=CC=C6)C(=O)C

DOS

IR

Vibrations