Geometry & MOs

Info

ID:	425801
PubChem CID:	135128071
Reduced:	ON2C11H11 (2)
Stoich.:	AB2C11D11 (2)
Weight, g/mol:	350.134303
ΔH_f, kcal/mol:	29.21
Dipole, Da:	5.78
IP(EA), eV:	-8.54(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2,4-difluorophenyl)-2-(2,3-dihydropyridin-2-yl)-N-methylquinazolin-4-amine

Drug info:

PubChemData

Smile

CNC1=NC(=NC2=C1C=C(C=C2)C3=CC(=CC=C3)OC)C4CC(=CN=C4)OC

DOS

IR

Vibrations