Geometry & MOs

Info

ID:	128083
PubChem CID:	51030457
Reduced:	SO2N6C24H24 (1)
Stoich.:	AB2C6D24E24 (1)
Weight, g/mol:	474.183795
ΔH_f, kcal/mol:	60.06
Dipole, Da:	10.05
IP(EA), eV:	-8.76(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[5-phenyl-4-(pyridin-2-ylmethylamino)quinazolin-2-yl]piperidine-1-sulfonamide

Drug info:

PubChemData

Smile

C1CC1(CNS(=O)(=O)N)C2=NC3=CC=CC(=C3C(=N2)NCC4=CC=CC=N4)C5=CC=CC=C5

DOS

IR

Vibrations