Geometry & MOs

Info

ID:	129940
PubChem CID:	51074325
Reduced:	SN3O3C17H21 (1)
Stoich.:	AB3C3D17E21 (1)
Weight, g/mol:	347.163377
ΔH_f, kcal/mol:	-71.24
Dipole, Da:	4.57
IP(EA), eV:	-9.54(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-oxoquinazolin-3-yl)-N-(1-phenylcyclobutyl)propanamide

Drug info:

PubChemData

Smile

CNS(=O)(=O)C1=CN(C(=C1)C(=O)NC2(CCC2)C3=CC=CC=C3)C

DOS

IR

Vibrations