Geometry & MOs

Info

ID:	225068
PubChem CID:	85736421
Reduced:	ON2H12C17 (2)
Stoich.:	AB2C12D17 (2)
Weight, g/mol:	563.43466
ΔH_f, kcal/mol:	81.36
Dipole, Da:	5.41
IP(EA), eV:	-8.95(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)NC4=CC=CC(=C4)C5=NC6=CC=CC=C6N=C5

DOS

IR

Vibrations