Geometry & MOs

Info

ID:	394992
PubChem CID:	135024363
Reduced:	N2O2H24C25 (1)
Stoich.:	A2B2C24D25 (1)
Weight, g/mol:	474.267114
ΔH_f, kcal/mol:	-15.72
Dipole, Da:	1.25
IP(EA), eV:	-8.69(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-bis(3,4-dimethylphenyl)-N-quinolin-8-ylbicyclo[2.2.1]heptane-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)C1=CC=C(C=C1)C2C3CCC(C3)C2C(=O)NC4=CC=CC5=C4N=CC=C5

DOS

IR

Vibrations