Geometry & MOs

Info

ID:	125014
PubChem CID:	50907285
Reduced:	O3N4C13H14 (1)
Stoich.:	A3B4C13D14 (1)
Weight, g/mol:	504.187801
ΔH_f, kcal/mol:	-50.62
Dipole, Da:	2.78
IP(EA), eV:	-10.06(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9,26-diphenylheptacyclo[14.10.2.02,7.08,28.010,15.019,27.020,25]octacosa-1(26),2,4,6,8,10,12,14,16(28),17,19(27),20,22,24-tetradecaene

Drug info:

PubChemData

Smile

CC1(CC12C(=O)N(C(=O)N2)NC(=O)C3=CN=CC=C3)C

DOS

IR

Vibrations