Geometry & MOs

Info

ID:	445127
PubChem CID:	135264655
Reduced:	NO3C27H33 (1)
Stoich.:	AB3C27D33 (1)
Weight, g/mol:	301.142641
ΔH_f, kcal/mol:	-84.33
Dipole, Da:	3.03
IP(EA), eV:	-9.22(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(2,5-dimethyl-4-oxo-4a,8a-dihydroquinazolin-3-yl)-3-methylpiperidine-2,6-dione

Drug info:

PubChemData

Smile

CC/1CC(C2=CC=CC=C2C(=O)/C(=C1/N(CC(C)(C)C3=CC=CC=C3C)C(=O)C)/C)O

DOS

IR

Vibrations