Geometry & MOs

Info

ID:	309646
PubChem CID:	126551828
Reduced:	O2C9H15 (2)
Stoich.:	A2B9C15 (2)
Weight, g/mol:	876.277678
ΔH_f, kcal/mol:	-211.98
Dipole, Da:	2.82
IP(EA), eV:	-10.46(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[3,5-bis(12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-10-yl)phenyl]-9-phenylcarbazole-3-carbonitrile

Drug info:

PubChemData

Smile

CCC1CCC(CC1)C(=O)OCCCCCCOC(=O)C=C

DOS

IR

Vibrations