Geometry & MOs

Info

ID:	85209
PubChem CID:	49872383
Reduced:	OF2N3H10C11 (2)
Stoich.:	AB2C3D10E11 (2)
Weight, g/mol:	373.179027
ΔH_f, kcal/mol:	-146.22
Dipole, Da:	8.94
IP(EA), eV:	-8.49(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-bicyclo[2.2.1]heptanyl)-N-(4-oxo-2-phenylquinazolin-3-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CN(C=N1)C2=C(C=C(C=C2)C3=NN(C(=N3)NC4=C(C(=CC(=C4)C(F)(F)F)OC)F)C)OC

DOS

IR

Vibrations