Geometry & MOs

Info

ID:	162216
PubChem CID:	57393969
Reduced:	O2N5C24H29 (1)
Stoich.:	A2B5C24D29 (1)
Weight, g/mol:	419.130363
ΔH_f, kcal/mol:	-14.22
Dipole, Da:	7.39
IP(EA), eV:	-8.8(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[2-methyl-3-(2-methylphenyl)-4-oxoquinazolin-7-yl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=CC=C1C2=CC3=C(N=C2)N=C(O3)N4CCC(CC4)N5CCCCC5

DOS

IR

Vibrations