Geometry & MOs

Info

ID:	318903
PubChem CID:	126653679
Reduced:	ON2C10H10 (1)
Stoich.:	AB2C10D10 (1)
Weight, g/mol:	584.257612
ΔH_f, kcal/mol:	17.34
Dipole, Da:	2.41
IP(EA), eV:	-9.11(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(9,9-dimethyl-10-pyridin-2-ylacridin-3-yl)oxy-13,13-dimethyl-1,18-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14(19),15,17-nonaene

Drug info:

PubChemData

Smile

CC1=CC=NN1C2=CC(=CC=C2)O

DOS

IR

Vibrations