Geometry & MOs

Info

ID:	231204
PubChem CID:	87572973
Reduced:	ON2H11C14 (2)
Stoich.:	AB2C11D14 (2)
Weight, g/mol:	252.160378
ΔH_f, kcal/mol:	116.01
Dipole, Da:	2.7
IP(EA), eV:	-8.34(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1CN(CN1C2=CC=CC=C2)C3=C(C(=C4C(=C3)C5=CC=CC=C5N4)C(=O)N=O)C6=CC=CC=C6

DOS

IR

Vibrations